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Jinan Trio PharmaTech Co., Ltd.

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Profile: Jinan Trio PharmaTech Co., Ltd. specializes in APIs & intermediates, heterocyclic compounds, and anti-tumor drugs. Our products include crizotinib, vemurafenib, afatinib, vandetanib, regorafenib, brivanib alaninate, pyridazine, imidazole, pyrazole, and oxazole. We are specialized in providing over 1000 products including molecular targeted anticancer drugs, cell signaling pathway inhibitors, pharmaceutical intermediates, and heterocyclic compounds, and quality services including custom synthesis, transfer of new drug patent and technology, technical cooperation, and process optimization.

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• A-205804
IUPAC Name: 4-(4-methylphenyl)sulfanylthieno[2,3-c]pyridine-2-carboxamide | CAS Registry Number: 251992-66-2
Synonyms: A 205804, 4-((4-Methylphenyl)thio)thieno(2,3-C)pyridine-2-carboxamide, 4-[(4-methylphenyl)thio]thieno[2,3-c]pyridine-2-carboxamide, UNII-TP7TB1SSZD, SureCN7057661, CHEMBL267678, CTK8E7415, CHEBI:100268, HMS3269O07, NCGC00167761-01, NCGC00167761-02, 4-(p-tolylthio)thieno[2,3-c]pyridine-2-carboxamide, BRD-K77627880-001-01-6, Thieno(2,3-C)pyridine-2-carboxamide, 4-((4-methylphenyl)thio)-

Molecular Formula: C15H12N2OS2Molecular Weight: 300.398580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QQGWEXFLMJGCAL-UHFFFAOYSA-N

• A-674563
IUPAC Name: (2S)-1-[5-(3-methyl-2H-indazol-5-yl)pyridin-3-yl]oxy-3-phenylpropan-2-amine | CAS Registry Number: 552325-73-2
Synonyms: A674563, (2s)-1-{[5-(3-Methyl-1h-Indazol-5-Yl)pyridin-3-Yl]oxy}-3-Phenylpropan-2-Amine, SureCN2191602, cc-293, CHEMBL379218, MolPort-021-804-899, BCP9000207, CS-0486, DB08568, QC-7249, NCGC00263147-01, HY-13254, X7452, A 674563, 5-{5-[(2S)-2-amino-3-phenylpropoxy]pyridin-3-yl}-3-methyl-1H-indazole, A-674563;552325-73-2, A-674563|552325-73-2|A674563, (S)-1-(5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)-3-phenylpropan-2-amine, SS3

Molecular Formula: C22H22N4OMolecular Weight: 358.436280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BPNUQXPIQBZCMR-IBGZPJMESA-N

• A-769662
IUPAC Name: 4-hydroxy-3-[4-(2-hydroxyphenyl)phenyl]-6-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile | CAS Registry Number: 844499-71-4
Synonyms: A 769662, 4-Hydroxy-3-(2'-hydroxy-1,1'-biphenyl-4-yl)-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carbonitrile, PubChem16661, cc-24, SureCN2669403, CHEMBL512504, CTK8E9331, CHEBI:546780, BCPP000450, ACT04835, AKOS015902474, BCP9000208, QC-6154, NCGC00250373-01, AK117003, KB-47022, FT-0653453, ST51054123, X7459, A10139

Molecular Formula: C20H12N2O3SMolecular Weight: 360.385880 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: CTESJDQKVOEUOY-UHFFFAOYSA-N

• A66
IUPAC Name: (2S)-1-N-[5-(2-tert-butyl-1,3-thiazol-4-yl)-4-methyl-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide | CAS Registry Number: 1166227-08-2
Synonyms: A-66, cc-500, MolPort-021-804-900, BCPP000449, BCP9000211, CS-0477, RL00633, HY-13261, KB-74372, BCP0726000206, X7447, A66|1166227-08-2|A-66, 1166227-08-2;A 66, A-66, (2S)-N1-(5-(2-tert-butylthiazol-4-yl)-4-methylthiazol-2-yl)pyrrolidine-1,2-dicarboxamide, (2S)-N1-[2-(tert-Butyl)-4'-methyl[4,5'-bithiazol]-2'-yl]-1,2-pyrrolidinedicarboxamide, (2S)-1-N-[5-(2-tert-butyl-1,3-thiazol-4-yl)-4-methyl-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide

Molecular Formula: C17H23N5O2S2Molecular Weight: 393.526820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: HBPXWEPKNBHKAX-NSHDSACASA-N

• Abemaciclib methanesulfonate
IUPAC Name: N-[5-[(4-ethylpiperazin-1-yl)methyl]pyridin-2-yl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;methanesulfonic acid | CAS Registry Number: 1231930-82-7
Synonyms: QCR-274, CS-1229, HY-16297, LY2835219, LY 2835219, LY-2835219, LY2835219|1231930-82-7|LY 2835219|LY-2835219, N-(5-((4-ethylpiperazin-1-yl)methyl)pyridin-2-yl)-5-fluoro-4-(4-fluoro-1-isopropyl-2-methyl-1H-benzo[d]imidazol-6-yl)pyrimidin-2-amine methanesulfonate

Molecular Formula: C28H36F2N8O3SMolecular Weight: 602.699046 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 12

InChIKey: NCJPFQPEVDHJAZ-UHFFFAOYSA-N

• ABT-737
IUPAC Name: 4-[4-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-yl]-N-[4-[[(2R)-4-(dimethylamino)-1-phenylsulfanylbutan-2-yl]amino]-3-nitrophenyl]sulfonylbenzamide | CAS Registry Number: 852808-04-9
Synonyms: ABT 737, ABT737, 4-[4-[(4'-Chloro[1,1'-biphenyl]-2-yl)methyl]-1-piperazinyl]-N-[[4-[[(1R)-3-(dimethylamino)-1-[(phenylthio)methyl]propyl]amino]-3-nitrophenyl]sulfonyl]benzamide, Benzamide, 4-[4-[(4'-chloro[1,1'-biphenyl]-2-yl)methyl]-1-piperazinyl]-N-[[4-[[(1R)-3-(dimethylamino)-1-[(phenylthio)methyl]propyl]amino]-3-nitrophenyl]sulfonyl]-, 2yxj, 4-{4-[(4'-chlorobiphenyl-2-yl)methyl]piperazin-1-yl}-N-{[4-({(1R)-3-(dimethylamino)-1-[(phenylsulfanyl)methyl]propyl}amino)-3-nitrophenyl]sulfonyl}benzamide, S1002_Selleck, PubChem20162, SureCN158942, UNII-Z5NFR173NV, cc-242, CHEMBL376408, QCR-51, N-Benylpiperazine derivative, 2, ABP000128, DNC007115, AKOS016003299, AM81254, CS-0014, ABT-737-Supplied by Selleck Chemicals

Molecular Formula: C42H45ClN6O5S2Molecular Weight: 813.426900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: HPLNQCPCUACXLM-PGUFJCEWSA-N

• ABT-751
IUPAC Name: N-[2-(4-hydroxyanilino)pyridin-3-yl]-4-methoxybenzenesulfonamide | CAS Registry Number: 141430-65-1
Synonyms: ABT751, ABT 751, CHEBI:124217, E-7010, NSC742134, CID3035714, E 7010, LS-31613, E7010, Benzenesulfonamide, N-(2-((4-hydroxyphenyl)amino)-3-pyridinyl)-4-methoxy-, N-(2-((4-Hydroxyphenyl)amino)-3-pyridinyl)-4-methoxybenzenesulfonamide, N-(2-(4-hydroxyphenylamino)pyridin-3-yl)-4-methoxybenzenesulfonamide, N-[2-(4-Hydroxy-phenylamino)-pyridin-3-yl]-4-methoxy-benzenesulfonamide, N-[2-[(4-hydroxyphenyl)amino]-3-pyridinyl]-4-methoxybenzenesulfonamide, 857447-92-8, E70

Molecular Formula: C18H17N3O4SMolecular Weight: 371.410280 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: URCVCIZFVQDVPM-UHFFFAOYSA-N

• ACETAMIDE, 2-METHOXY-N-[3-[4-[[3-METHYL-4-[(6-METHYL-3-PYRIDINYL)OXY]PHENYL]AMINO]-6-QUINAZOLINYL]-2-PROPEN-1-YL]-
IUPAC Name: 2-methoxy-N-[3-[4-[3-methyl-4-(6-methylpyridin-3-yl)oxyanilino]quinazolin-6-yl]prop-2-enyl]acetamide | CAS Registry Number: 537705-08-1
Synonyms: AG-F-35231, AG-F-85228, SureCN4617807, CTK4H9805, CTK4J8758, HMS3244K05, HMS3244K06, HMS3244L05, HMS3265A21, HMS3265A22, HMS3265B21, HMS3265B22, NCGC00263101-01

Molecular Formula: C27H27N5O3Molecular Weight: 469.534980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: LLVZBTWPGQVVLW-UHFFFAOYSA-N

• Aclarubicin
IUPAC Name: methyl (1R,2R,4S)-4-[(2R,4S,5S,6S)-4-(dimethylamino)-5-[(2S,4S,5S,6S)-4-hydroxy-6-methyl-5-[(2R,6S)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate | CAS Registry Number: 57576-44-0
Synonyms: aclarubicin, Aclacinomycin A, Aclaplastin, Aclacinon, Jaclacin, Aclacin, Spartanamicin B, Spectrum_000467, Spectrum2_001934, Spectrum4_000768, Spectrum5_001041, Aclarubicin (USAN/INN), KBioGR_001156, KBioSS_000947, SPBio_001967, KBio2_000947, KBio2_003515, KBio2_006083, AIDS000124, AIDS-000124

Molecular Formula: C42H53NO15Molecular Weight: 811.867920 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 16

InChIKey: USZYSDMBJDPRIF-SVEJIMAYSA-N

• Adavosertib
IUPAC Name: 1-[6-(2-hydroxypropan-2-yl)pyridin-2-yl]-6-[4-(4-methylpiperazin-1-yl)anilino]-2-prop-2-enylpyrazolo[3,4-d]pyrimidin-3-one | CAS Registry Number: 955365-80-7
Synonyms: MK-1775, MK1775, MK 1775, MK1775, MK-1775, 2-allyl-1-(6-(2-hydroxypropan-2-yl)pyridin-2-yl)-6-(4-(4-methylpiperazin-1-yl)phenylamino)-1H-pyrazolo[3,4-d]pyrimidin-3(2H)-one, 3H-Pyrazolo(3,4-d)pyrimidin-3-one, 1,2-dihydro-1-(6-(1-hydroxy-1-methylethyl)-2-pyridinyl)-6-((4-(4-methyl-1-piperazinyl)phenyl)amino)-2-(2-propen-1-yl)-, 3H-Pyrazolo[3,4-d]pyrimidin-3-one, 1,2-dihydro-1-[6-(1-hydroxy-1-methylethyl)-2-pyridinyl]-6-[[4-(4-methyl-1-piperazinyl)phenyl]amino]-2-(2-propen-1-yl)-, S1525_Selleck, Kinome_2656, UNII-K2T6HJX3I3, SureCN1504444, cc-686, QCR-46, MolPort-016-633-227, DCL000569, AM90274, BCP9000937, CS-0105, MK-1775-Supplied by Selleck Chemicals, NCGC00263183-01

Molecular Formula: C27H32N8O2Molecular Weight: 500.595380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: BKWJAKQVGHWELA-UHFFFAOYSA-N

• Adezmapimod
IUPAC Name: 4-[4-(4-fluorophenyl)-2-(4-methylsulfinylphenyl)-1H-imidazol-5-yl]pyridine | CAS Registry Number: 152121-47-6
Synonyms: 1pme, Tocris-1202, Tocris-1402, SB 203580, CBiol_001970, BSPBio_001104, nchembio.2007.59-comp4, SB-203580, S8307_SIGMA, SB203580, BIS0733, InSolution™ SB 203580, CHEBI:100250, MolPort-000-006-291, AIDS155260, AIDS220089, Bio1_000256, Bio1_000745, Bio1_001234, AIDS-155260

Molecular Formula: C21H16FN3OSMolecular Weight: 377.434643 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CDMGBJANTYXAIV-UHFFFAOYSA-N

• Afatinib
IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide | CAS Registry Number: 850140-72-6
Synonyms: Tovok, BIBW2992, BIBW 2992, Tomtovok, 439081-18-2, BIBW-2992, Gilotrif, S1011_Selleck, CHEBI:61390, Tovok, BIBW2992, UNII-41UD74L59M, CHEMBL1173655, CHEBI:750126, FT-0083487, (2E)-N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[(3S)-tetrahydrofuran-3-yloxy]quinazolin-6-yl}-4-(dimethylamino)but-2-enamide, N-[4-[(3-chloro-4-fluorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-4-(dimethylamino)-2-Butenamide, (S,E)-N-(4-(3-chloro-4-fluorophenylamino)-7-(tetrahydrofuran-3-yloxy)quinazolin-6-yl)-4-(dimethylamino)but-2-enamide, 2-Butenamide, N-(4-((3-chloro-4-fluorophenyl)amino)-7-(((3S)-tetrahydro-3-furanyl)oxy)-6-quinazolinyl)-4-(dimethylamino)-, 915958-11-1, N-[4-[(3-Chloro-4-fluorophenyl)amino]-7-[[(3''S'')-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-4(dimethylamino)-2-butenamide

Molecular Formula: C24H25ClFN5O3Molecular Weight: 485.938403 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: ULXXDDBFHOBEHA-CWDCEQMOSA-N

• Afatinib Dimaleate
IUPAC Name: (Z)-but-2-enedioic acid;(E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide | CAS Registry Number: 850140-73-7
Synonyms: AFATINIB DIMALEATE, BIBW 2992MA2, CHEBI:76003, Gilotrif, Afatinib dimaleate (USAN), Afatinib dimaleate [USAN], Afatinib maleate, Gilotrif (TN), Afatinib (diMaleate), Afatinib maleate (JAN), UNII-V1T5K7RZ0B, BIBW2992 MA2, BIBW2992-MA2, CHEMBL2105712, HY-10261A, CS-1329, QC-11139, D09733, Afatinib dimaleate|850140-73-7|BIBW-2992|BIBW2992|BIBW 2992|Afatinib, (2E)-N-(4-((3-Chloro-4-fluorophenyl)amino)-7-(((3S)-tetrahydrofuran-3-yl)oxy)quinazolin- 6-yl)-4-(dimethylamino)but-2-enamide bis(hydrogen (2Z)-but-2-enedioate)

Molecular Formula: C32H33ClFN5O11Molecular Weight: 718.082723 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 16

InChIKey: USNRYVNRPYXCSP-JUGPPOIOSA-N

• AG1024
IUPAC Name: 2-[(3-bromo-5-tert-butyl-4-hydroxyphenyl)methylidene]propanedinitrile | CAS Registry Number: 65678-07-1
Synonyms: Tyrphostin AG 1024, AG 1024, ag1024, 3-Bromo-5-t-butyl-4-hydroxy-benzylidenemalonitrile, (3-bromo-5-tert-butyl-4-hydroxybenzylidene)malononitrile, 2-(3-bromo-5-tert-butyl-4-hydroxybenzylidene)malononitrile, propanedinitrile, [[3-bromo-5-(1,1-dimethylethyl)-4-hydroxyphenyl]methylene]-, AG-1024, AC1L1CSO, AG-1024 - Tyrphostin, cc-273, AC1Q25S8, CHEMBL2218926, CTK2F4655, MolPort-016-580-654, HMS3229A03, KST-1A7453, ABP001001, AR-1A4101, HSCI1_000032

Molecular Formula: C14H13BrN2OMolecular Weight: 305.169820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ABBADGFSRBWENF-UHFFFAOYSA-N

• AG490
IUPAC Name: (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide | CAS Registry Number: 133550-30-8
Synonyms: Tyrphostin B42, 2-Propenamide, Tyrphostin AG 490, tyrphostin AG-490, Tyrphostin deriv. 42, Tocris-0414, BiomolKI_000025, Lopac-T-3434, Tyrphostin-?AG-?490, BiomolKI2_000033, Lopac0_001166, BSPBio_001396, MLS002153172, T3434_SIGMA, AG 490, AG-490, CHEBI:187221, MolPort-001-761-274, AIDS080808, HMS1989F18

Molecular Formula: C17H14N2O3Molecular Weight: 294.304660 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: TUCIOBMMDDOEMM-RIYZIHGNSA-N

• Agerafenib
IUPAC Name: 1-[3-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-[5-(1,1,1-trifluoro-2-methylpropan-2-yl)-1,2-oxazol-3-yl]urea | CAS Registry Number: 1188910-76-0
Synonyms: CEP-32496, CEP32496, UNII-78I4VEX88N, 78I4VEX88N, CHEMBL2029988, GTPL7880, SCHEMBL1015932, MolPort-029-701-896, CEP 32496, AKOS023600525, CS-1115, AC013773, HY-15200, KB-76009, Q-4110, 1-[3-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-[5-(1,1,1-trifluoro-2-methylpropan-2-yl)-1,2-oxazol-3-yl]urea

Molecular Formula: C24H22F3N5O5Molecular Weight: 517.457190 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 11

InChIKey: DKNUPRMJNUQNHR-UHFFFAOYSA-N

• AICAR
IUPAC Name: 5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazole-4-carboxamide | CAS Registry Number: 2627-69-2
Synonyms: ACADESINE, AICA-riboside, Arasine, Protara, AIC-Riboside, Z-Riboside, AICA riboside, AICA, Acadesine (USAN/INN), Acadesinum [INN-Latin], Acadesina [INN-Spanish], Acadesine [USAN:BAN:INN], AIDS016108, AIDS-016108, EINECS 220-097-5, HSCI1_000213, NSC105823, GP-1-110, NSC 105823, 5-Aminoimidazole-4-carboxamide riboside

Molecular Formula: C9H14N4O5Molecular Weight: 258.231260 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 8

InChIKey: RTRQQBHATOEIAF-UUOKFMHZSA-N

• Alectinib
IUPAC Name: 9-ethyl-6,6-dimethyl-8-(4-morpholin-4-ylpiperidin-1-yl)-11-oxo-5H-benzo[b]carbazole-3-carbonitrile | CAS Registry Number: 1256580-46-7
Synonyms: CH5424802, CHEMBL1738797, AF802, CH 5424802, CH-5424802, 9-ethyl-6,11-dihydro-6,6-dimethyl-8-(4-(4-morpholinyl)-1-piperidinyl)-11-oxo-5h-benzo(b)carbazole-3-carbonitrile, 9-Ethyl-6,11-dihydro-6,6-dimethyl-8-[4-(4-morpholinyl)-1-piperidinyl]-11-oxo-5H-benzo[b]carbazole-3-carbonitrile, UNII-LIJ4CT1Z3Y, SureCN896753, cc-247, QCR-83, AF 802, BCP9000514, CS-0518, RL01191, NCGC00346688-01, HY-13011, Y0295, CH5424802,CAS:1256580-46-7, 1256580-46-7 , C30H34N4O2 , CH 5424802 , CH-5424802

Molecular Formula: C30H34N4O2Molecular Weight: 482.616560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: KDGFLJKFZUIJMX-UHFFFAOYSA-N

• Alisertib
IUPAC Name: 4-[[9-chloro-7-(2-fluoro-6-methoxyphenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]-2-methoxybenzoic acid | CAS Registry Number: 1028486-01-2
Synonyms: MLN8237, MLN-8237, MLN 8237, MLN-8237, MLN8237, 4-((9-Chloro-7-(2-fluoro-6-methoxyphenyl)-5H-benzo[c]pyrimido[4,5-e]azepin-2-yl)amino)-2-methoxybenzoic acid, MLN 8237, 1028486-01-2, 4-[[9-Chloro-7-(2-fluoro-6-methoxyphenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]-2-methoxybenzoic acid, Alisertib (USAN), S1133_Selleck, MLN8237,Alisertib, Kinome_3770, PubChem22398, Alisertib [USAN:INN], MLN8237 (Alisertib), MLN8237 - Alisertib, SureCN855823, JSPY-st000258, cc-313, UNII-T66ES73M18, CHEMBL483158

Molecular Formula: C27H20ClFN4O4Molecular Weight: 518.923503 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: ZLHFILGSQDJULK-UHFFFAOYSA-N

• Allitinib
IUPAC Name: N-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]quinazolin-6-yl]prop-2-enamide | CAS Registry Number: 897383-62-9
Synonyms: AST-1306, AST 1306, N-{4-[3-chloro-4-(3-fluoro-benzyloxy)phenylamino]quinazolin-6-yl}-acrylamide, SureCN233985, cc-669, CHEMBL1947204, AST1306, QCR-149, BCP9000327, CS-0983, RL05640, NCGC00346478-02, HY-15375, Y0355, 147311-EP2269994A1, 147311-EP2292234A1, AST-1306|897383-62-9|AST 1306, 897383-62-9 , AST1306 , AST 1306, N-(4-(3-chloro-4-(3-fluorobenzyloxy)phenylamino)quinazolin-6-yl)acrylamide, n-(4-((3-chloro-4-((3-fluorophenyl)methoxy)phenyl)amino)-6-quinazolinyl)-2-propenamide

Molecular Formula: C24H18ClFN4O2Molecular Weight: 448.876723 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: MVZGYPSXNDCANY-UHFFFAOYSA-N

• Alogliptin
IUPAC Name: 2-[[6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile | CAS Registry Number: 850649-61-5
Synonyms: UNII-JHC049LO86, CHEMBL376359, CHEBI:72323, MolPort-005-933-065, 2-({6-[(3r)-3-Aminopiperidin-1-Yl]-3-Methyl-2,4-Dioxo-3,4-Dihydropyrimidin-1(2h)-Yl}methyl)benzonitrile, alogliptina, alogliptine, alogliptinum, CID11450633, Alogliptin (SYR-322), SureCN121028, JHC049LO86, DCL000421, DB06203, FT-0661522, X4993, 2-[[6-[(3R)-3-Amino-1-piperidinyl]-3,4-dihydro-3-methyl-2,4-dioxo-1(2H)-pyrimidinyl]methyl]benzonitrile

Molecular Formula: C18H21N5O2Molecular Weight: 339.391640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: ZSBOMTDTBDDKMP-OAHLLOKOSA-N

• Alpelisib
IUPAC Name: (2S)-1-N-[4-methyl-5-[2-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridin-4-yl]-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide | CAS Registry Number: 1217486-61-7
Synonyms: BYL-719, BYL719, CHEMBL2396661, QCR-1, cc-697, BYL 719; BYL719, CS-0663, HY-15244, KB-75843, cas:1217486-61-7;BYL-719, BYL-719|1217486-61-7|BYL719, (2s)-N~1~-{4-Methyl-5-[2-(1,1,1-Trifluoro-2-Methylpropan-2-Yl)pyridin-4-Yl]-1,3-Thiazol-2-Yl}pyrrolidine-1,2-Dicarboxamide, (2S)-N1-[4-Methyl-5-[2-(2,2,2-trifluoro-1,1-dimethylethyl)-4-pyridinyl]-2-thiazolyl]-1,2-pyrrolidinedicarboxamide, 1LT

Molecular Formula: C19H22F3N5O2SMolecular Weight: 441.470490 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: STUWGJZDJHPWGZ-LBPRGKRZSA-N

• Alvespimycin hydrochloride
IUPAC Name: [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-21-(2-dimethylaminoethylamino)-6-hydroxy-5,11-dimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate hydrochloride | CAS Registry Number: 467214-21-7
Synonyms: 17DMAG, 17-DMAG, Alvespimycin hydrochloride (USAN), CID9852573, NSC 707545, D06554, 17-Desmethoxy-17-N,N-dimethylaminoethylamino-geldanamycin, HCl, 17-N,N-Dimethylaminoethylamino-17-demethoxy-geldanamycin, HCl

Molecular Formula: C32H49ClN4O8Molecular Weight: 653.206460 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: DFSYBWLNYPEFJK-IHLRWNDRSA-N

• AMG 900
IUPAC Name: N-[4-[3-(2-aminopyrimidin-4-yl)pyridin-2-yl]oxyphenyl]-4-(4-methylthiophen-2-yl)phthalazin-1-amine | CAS Registry Number: 945595-80-2
Synonyms: AMG-900, AMG900, N-(4-(3-(2-aminopyrimidin-4-yl)pyridin-2-yloxy)phenyl)-4-(4-methylthiophen-2-yl)phthalazin-1-amine, cc-2, SureCN503564, UNII-9R2G075611, BCP9000292, CS-0485, QC-9197, RL05957, NCGC00263094-01, HY-13253, X7461, AMG900; 945595-80-2, AMG 900|945595-80-2|AMG900, N-(4-(3-(2-aminopyrimidin-4-yl)pyridin-2-yloxy)phenyl)-4-(4-methylthiophen- 2-yl)phthalazin-1-amine, N-(4-{[3-(2-aminopyrimidin-4-yl)pyridin-2-yl]oxy}phenyl)-4-(4-methylthiophen-2-yl)phthalazin-1-amine

Molecular Formula: C28H21N7OSMolecular Weight: 503.577640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: IVUGFMLRJOCGAS-UHFFFAOYSA-N

• AMG-208
IUPAC Name: 7-methoxy-4-[(6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy]quinoline | CAS Registry Number: 1002304-34-8
Synonyms: AMG 208, 7-methoxy-4-((6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy)quinoline, AMG208, 1002304-34-8, AMG208, AMG-208, 7-methoxy-4-({6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}methoxy)quinoline, Triazolopyridazine, 4, S1316_Selleck, 3cd8, UNII-Y2SR66P7VM, SureCN9910136, cc-218, AMG208, CHEMBL496102, QCR-184, MolPort-016-633-199, AKOS015852294, BCP9000287, CS-0185, DB08079, RL00020

Molecular Formula: C22H17N5O2Molecular Weight: 383.402680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: HEAIZQNMNCHNFD-UHFFFAOYSA-N

• AMG-458
IUPAC Name: 1-(2-hydroxy-2-methylpropyl)-N-[5-(7-methoxyquinolin-4-yl)oxypyridin-2-yl]-5-methyl-3-oxo-2-phenylpyrazole-4-carboxamide | CAS Registry Number: 913376-83-7
Synonyms: AMG458, AMG 458, SureCN197714, Substituted Pyrazolone, 17, cc-602, UNII-4535RW5Y3A, CHEMBL460472, AMG-458,AMG458, NCGC00346670-01, AMG 458; 913376-83-7, 1-(2-Hydroxy-2-methylpropyl)-N-(5-((7-methoxyquinolin-4-yl)oxy)pyridin-2-yl)-5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide, 1-(2-hydroxy-2-methylpropyl)-N-{5-[(7-methoxyquinolin-4-yl)oxy]pyridin-2-yl}-5-methyl-3-oxo-2-phenylpyrazole-4-carboxamide, 1H-Pyrazole-4-carboxamide, 2,3-dihydro-1-(2-hydroxy-2-methylpropyl)-N-(5-((7-methoxy-4-quinolinyl)oxy)-2-pyridinyl)-5-methyl-3-oxo-2-phenyl-

Molecular Formula: C30H29N5O5Molecular Weight: 539.581760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: GLBZSOQDAOLMGC-UHFFFAOYSA-N

• Amiodarone hydrochloride
IUPAC Name: (2-butyl-1-benzofuran-3-yl)-[4-(2-diethylaminoethyloxy)-3,5-diiodophenyl]methanone hydrochloride | CAS Registry Number: 19774-82-4
Synonyms: amiodarone, Cordarone, Ancaron, Cordarone (TN), Prestwick_707, Ancaron (TN), MLS000028520, MLS001076313, SPECTRUM2300165, Amiodarone hydrochloride (JAN), calcium channel (L type) blocker, CID441325, RJC 02270, NCGC00093613-01, NCGC00093613-02, NCGC00093613-03, NCGC00093613-04, CPD000058296, SAM001246646, SMR000058296

Molecular Formula: C25H30ClI2NO3Molecular Weight: 681.772540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ITPDYQOUSLNIHG-UHFFFAOYSA-N

• Amprenavir
IUPAC Name: [(3S)-oxolan-3-yl] N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate | CAS Registry Number: 161814-49-9
Synonyms: amprenavir, Agenerase, Prozei, Vertex, Vertex VX478, 1hpv, Amprenavir [USAN], Agenerase (TM), Agenerase (TN), GNA & Amprenavir, HHA & Amprenavir, 1t7j, VX-478, VX 478, HSDB 7157, Amprenavir (JAN/USAN/INN), DRG-0258, C25H35N3O6S, CHEBI:40050, KVX-478

Molecular Formula: C25H35N3O6SMolecular Weight: 505.626900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: YMARZQAQMVYCKC-OEMFJLHTSA-N

• Amuvatinib
IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-([1]benzofuro[3,2-d]pyrimidin-4-yl)piperazine-1-carbothioamide | CAS Registry Number: 850879-09-3
Synonyms: MP470, MP-470, MP 470, MP470, MP-470, HPK56, N-(benzo[d][1,3]dioxol-5-ylmethyl)-4-(benzofuro[3,2-d]pyrimidin-4-yl)piperazine-1-carbothioamide, S1244_Selleck, PubChem22479, Amuvatinib (USAN/INN), Amuvatinib [USAN:INN], UNII-SO9S6QZB4R, AGN-PC-005XUY, cc-525, CHEMBL2103851, BCPP000157, HMS3244A11, HMS3244A12, HMS3244B11, Amuvatinib (MP-470, HPK 56), ABP000937

Molecular Formula: C23H21N5O3SMolecular Weight: 447.509540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: FOFDIMHVKGYHRU-UHFFFAOYSA-N

• Apatinib (YN968D1)
IUPAC Name: N-[4-(1-cyanocyclopentyl)phenyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;methanesulfonic acid | CAS Registry Number: 811803-05-1
Synonyms: YN968D1, YN-968D1, 1218779-75-9, Apatinib - YN968D1, UNII-TK02X14ASJ, cc-605, BCP9000308, CS-0694, HY-13342, Lapatinib;YN968D1;811803-05-1, Apatinib|1218779-75-9|YN968D1|YN-968D1, 1275609-10-3, 3-Pyridinecarboxamide, N-(4-(1-cyanocyclopentyl)phenyl)-2-((4-pyridinylmethyl)amino)-, methanesulfonate (1:1), N-[4-(1-cyanocyclopentyl)phenyl]-2-[(pyridin-4-ylmethyl)amino]pyridine-3-carboxamide mesylate

Molecular Formula: C25H27N5O4SMolecular Weight: 493.577980 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: FYJROXRIVQPKRY-UHFFFAOYSA-N

• Apitolisib
IUPAC Name: (2S)-1-[4-[[2-(2-aminopyrimidin-5-yl)-7-methyl-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl]piperazin-1-yl]-2-hydroxypropan-1-one | CAS Registry Number: 1032754-93-0
Synonyms: GDC-0980, GDC0980, CHEMBL1922094, RG7422, 1032754-93-0, (2s)-1-(4-{[2-(2-Aminopyrimidin-5-Yl)-7-Methyl-4-(Morpholin-4-Yl)thieno[3,2-D]pyrimidin-6-Yl]methyl}piperazin-1-Yl)-2-Hydroxypropan-1-One, (S)-1-(4-((2-(2-aminopyrimidin-5-yl)-7-methyl-4-morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)-2-hydroxypropan-1-one, GNE 390; GDC 0980; RG 7422, GDC 0980, PubChem24448, cc-6, Apitolisib [USAN:INN], SureCN466297, UNII-1C854K1MIJ, QCR-182, GDC-0980,RG7422, RG7422, BCP9000717, CS-0590, GDC-0980.1, RG 7422

Molecular Formula: C23H30N8O3SMolecular Weight: 498.601100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 11

InChIKey: YOVVNQKCSKSHKT-HNNXBMFYSA-N

• ARQ-197
Synonyms: Tivantinib, ARQ 197, 905854-02-6, (3R,4R)-3-(5,6-Dihydro-4H-pyrrolo(3,2,1-ij)quinolin-1-yl)-4-(1H-indol-3-yl)pyrrolidine-2,5-dione, ARQ197, (3R,4R)-3-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)-4-(1H-indol-3-yl)pyrrolidine-2,5-dione, 1228508-24-4, Tivantinib [INN], ARQ 197, Tivantinib, Tivantinib (USAN/INN), Tivantinib [USAN:INN], SureCN44944, ARQ 197 (Tivantinib), cc-86, UNII-PJ4H73IL17, CHEMBL2103882, QCR-102, ARQ-197,Tivantinib, ARQ197, ARQ197; ARQ-197;Tivantinib, BCPP000042

Molecular Formula: C23H19N3O2Molecular Weight: 369.415860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UCEQXRCJXIVODC-PMACEKPBSA-N

• ARRY-380 (analog )
IUPAC Name: 6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazolin-4-amine | CAS Registry Number: 937265-83-3
Synonyms: Arry-380, Arry 380, Arry380, SureCN10169911, cc-595, UNII-H32S1659ED, BCP9000319, CS-0484, NCGC00346672-01, HY-10531, KB-74736, Arry380; 937265-83-3, ARRY-380|937265-83-3|ARRY 380, 6-(5-{[(2-methanesulfonylethyl)amino]methyl}furan-2-yl)-N-(3-methyl-4-{[1,2,4]triazolo[1,5-a]pyridin-7-yloxy}phenyl)quinazolin-4-amine

Molecular Formula: C29H27N7O4SMolecular Weight: 569.634180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: QVMNYGOVNWWFKF-UHFFFAOYSA-N

• AS-252424
IUPAC Name: 5-[[5-(4-fluoro-2-hydroxyphenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dione | CAS Registry Number: 900515-16-4
Synonyms: AGN-PC-00D0WV, CTK5G7332, (5Z)-5-[[5-(4-fluoro-2-hydroxyphenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dione, 5-((5-(4-Fluoro-2-hydroxyphenyl)furan-2-yl)methylene)thiazolidine-2,4-dione, HMS3244G19, HMS3244G20, HMS3244H19, 1138220-19-5, AG-H-68553, NCGC00185997-03, KB-243175

Molecular Formula: C14H8FNO4SMolecular Weight: 305.281023 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: OYYVWNDMOQPMGE-UHFFFAOYSA-N

• AS-604850
IUPAC Name: 5-[(2,2-difluoro-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidine-2,4-dione | CAS Registry Number: 648449-76-7
Synonyms: AGN-PC-00A7CP, CTK8F0347, NCGC00186009-03, 2,4-Thiazolidinedione, 5-[(2,2-difluoro-1,3-benzodioxol-5-yl)methylene]-

Molecular Formula: C11H5F2NO4SMolecular Weight: 285.223506 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: SRLVNYDXMUGOFI-UHFFFAOYSA-N

• AS-605240
IUPAC Name: 5-(quinoxalin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione | CAS Registry Number: 648450-29-7
Synonyms: CTK5C1779, HMS3265I21, HMS3265I22, HMS3265J21, HMS3265J22, IN1150, AG-G-43583, NCGC00186030-03, KB-40972, 2,4-Thiazolidinedione,5-(6-quinoxalinylmethylene)-, 5-(6-Quinoxalinylmethyl ene)-2,4-thiazolidinedione, 5-(quinoxalin-6-ylmethylene)thiazolidine-2,4-dione, 5-(Quinoxalin-6-ylmethylene)thiazolidine-2,4-dione;AS 605240;

Molecular Formula: C12H7N3O2SMolecular Weight: 257.267880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: SQWZFLMPDUSYGV-UHFFFAOYSA-N

• Aspirin
IUPAC Name: 2-acetyloxybenzoic acid | CAS Registry Number: 50-78-2
Synonyms: aspirin, Acylpyrin, Colfarit, Ecotrin, Acetylsalicylate, Enterosarein, Acenterine, Polopiryna, Micristin, Acetosal, Easprin, ACETYLSALICYLIC ACID, Acetosalic acid, Enterosarine, Acetophen, Acetosalin, Acetylsal, Aspirdrops, Bialpirina, Clariprin

Molecular Formula: C9H8O4Molecular Weight: 180.157420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: BSYNRYMUTXBXSQ-UHFFFAOYSA-N

• AT7519
IUPAC Name: 4-[(2,6-dichlorobenzoyl)amino]-N-piperidin-4-yl-1H-pyrazole-5-carboxamide | CAS Registry Number: 844442-38-2
Synonyms: AT-7519, AT 7519, N-(4-Piperidinyl)-4-(2,6-dichlorobenzoylamino)-1H-pyrazole-3-carboxamide, 4-(2,6-dichlorobenzamido)-N-(piperidin-4-yl)-1H-pyrazole-3-carboxamide, PubChem22418, SureCN955568, UNII-X1BF92PW9T, cc-301, MolPort-016-633-226, BCPP000381, HMS3265A09, HMS3265A10, HMS3265B09, HMS3265B10, ABP000847, AT7519-Supplied by Selleck Chemicals, BCP9000335, CS-0017, RL05190, NCGC00263091-01

Molecular Formula: C16H17Cl2N5O2Molecular Weight: 382.244480 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: OVPNQJVDAFNBDN-UHFFFAOYSA-N

• AT7867
IUPAC Name: 4-(4-chlorophenyl)-4-[4-(1H-pyrazol-4-yl)phenyl]piperidine | CAS Registry Number: 857531-00-1
Synonyms: AT 7867, AT-7867, 4-(4-chlorophenyl)-4-[4-(1H-pyrazol-4-yl)phenyl]piperidine, 4-(4-(1H-pyrazol-4-yl)phenyl)-4-(4-chlorophenyl)piperidine, AT-7867, AT7867, 4-(4-chlorophenyl)-4-(4-(1h-pyrazol-4-yl)phenyl)piperidine, GVP, S1558_Selleck, pyrazole-based inhibitor 9, SureCN1977655, cc-116, CHEMBL428462, CTK3C8308, MolPort-016-633-237, BCPP000380, ACN-S001861, AT7867-Supplied by Selleck Chemicals, BCP9000336, CS-0218, DB07859

Molecular Formula: C20H20ClN3Molecular Weight: 337.845900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LZMOSYUFVYJEPY-UHFFFAOYSA-N

• AT9283
IUPAC Name: 1-cyclopropyl-3-[3-[5-(morpholin-4-ylmethyl)benzimidazol-2-ylidene]-1,2-dihydropyrazol-4-yl]urea | CAS Registry Number: 896466-04-9
Synonyms: 1-Cyclopropyl-3-(3-(5-(morpholinomethyl)-1H-benzo[d]imidazol-2-yl)-1H-pyrazol-4-yl)urea, SureCN545809, SureCN545942, CTK8C2842, HMS3244O09, HMS3244O10, HMS3244P09, ANW-69120, NCGC00346493-01, KB-74758

Molecular Formula: C19H23N7O2Molecular Weight: 381.431620 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: VRXXZJLHPWWXIX-UHFFFAOYSA-N

• Atazanavir sulfate
IUPAC Name: methyl N-[(2S)-1-[[(2S,3S)-3-hydroxy-4-[[[(2S)-2-(methoxycarbonylamino)-3,3-dimethylbutanoyl]amino]-[(4-pyridin-2-ylphenyl)methyl]amino]-1-phenylbutan-2-yl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamate; sulfuric acid | CAS Registry Number: 229975-97-7
Synonyms: Reyataz, Zrivada, Atanazavir sulfate, Reyataz (TN), Atazanavir sulfate [USAN], Atazanavir sulfate (JAN/USAN), BMS-232632-05, CGP-73547, CID158550, BMS-232632, LS-186585, D01276, 2,5,6,10,13-Pentaazatetradecanedioic acid, 3,12-bis(1,1-dimethylethyl)-8-hydroxy-4,11-dioxo-9-(phenylmethyl)-6-((4-(2-pyridinyl)phenyl)methyl)-, dimethyl ester, (3S,8S,9S,12S)-, sulfate (1:1) (salt), 2,5,6,10,13-Pentaazatetradecanedioic acid, 3-12-bis(1,1-dimethylethyl)-8-hydroxy-4,11-dioxo-9-(phenylmethyl)-6-((-4-(2-pyridinyl)phenyl)methyl)-, dimethyl ester, (3S,8S,9S,12S)-, sulfate (1:1) (salt), Dimethyl (3S,8S,9S,12S)-9-benzyl-3,12,di-tert-butyl-8-hydroxy-4,11-dioxo-6-(p-2-pyridylbenzyl)-2,5,6,10,13-pentaazatetradecanedioate, sulfate (1:1) (salt)

Molecular Formula: C38H54N6O11SMolecular Weight: 802.933960 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 13

InChIKey: DQSGVVGOPRWTKI-QVFAWCHISA-N

• Avagacestat
IUPAC Name: (2R)-2-[(4-chlorophenyl)sulfonyl-[[2-fluoro-4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]amino]-5,5,5-trifluoropentanamide | CAS Registry Number: 1146699-66-2
Synonyms: BMS-708163, BMS 708163, BMS-708163-01, BMS708163, Avagacestat (USAN), Avagacestat [USAN], BMS708163, 1146699-66-2, BMS708163, BMS-708163, S1262_Selleck, Avagacestat [USAN:INN], SureCN310019, UNII-TQ44WWY45Q, cc-297, CHEMBL1090771, BCPP000327, (2R)-2-[N-[(4-CHLOROPHENYL)SULFONYL]-N-[2-FLUORO-4-(1,2,4-OXADIAZOL-3-YL)BENZYL]AMINO]-5,5,5-TRIFLUOROPENTANAMIDE, AKOS005146523, AKOS016016280, BCP9000429, CS-0180

Molecular Formula: C20H17ClF4N4O4SMolecular Weight: 520.884993 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 11

InChIKey: XEAOPVUAMONVLA-QGZVFWFLSA-N

• Axitinib
IUPAC Name: N-methyl-2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]benzamide | CAS Registry Number: 319460-85-0
Synonyms: Axitinib [USAN], AG-013736, CID6450551, AG-13736, AG 013736, Benzamide, N-methyl-2-((3-((1E)-2-(2-pyridinyl)ethenyl)-1H-indazo)-6-yl)thio)-, N-methyl-2-((3-((1E)-2-(pyridin-2-yl)ethenyl)-1H-indazol-6-yl)sulfanyl)benzamide, 790713-39-2

Molecular Formula: C22H18N4OSMolecular Weight: 386.469520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RITAVMQDGBJQJZ-FMIVXFBMSA-N

• AZ 628
IUPAC Name: 3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxoquinazolin-6-yl)amino]phenyl]benzamide | CAS Registry Number: 878739-06-1
Synonyms: AZ628, AZ-628, CHEMBL2144069, 3-(2-cyanopropan-2-yl)-N-(4-methyl-3-(3-methyl-4-oxo-3,4-dihydroquinazolin-6-ylamino)phenyl)benzamide, 3-(2-Cyanopropan-2-yl)-N-(4-methyl-3-((3-methyl-4-oxo-3,4-dihydroquinazolin-6-yl)amino)phenyl)benzamide, 3-(2-Cyanopropan-2-Yl)-N-{4-Methyl-3-[(3-Methyl-4-Oxo-3,4-Dihydroquinazolin-6-Yl)amino]phenyl}benzamide, cc-82, AGN-PC-00DXO2, SureCN4209241, UNII-560S6B5D79, QCR-186, HMS3265I11, HMS3265I12, HMS3265J11, HMS3265J12, AKOS016011304, BCP9000346, CS-0091, RL05473, NCGC00250380-01

Molecular Formula: C27H25N5O2Molecular Weight: 451.519700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ZGBGPEDJXCYQPH-UHFFFAOYSA-N

• AZ960
IUPAC Name: 5-fluoro-2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridine-3-carbonitrile | CAS Registry Number: 905586-69-8
Synonyms: AZ 960, AZ-960, AZ 960, AZ960, S2214_Selleck, UNII-M63IS9PTJF, cc-210, CHEMBL1774055, MolPort-016-633-317, BCPP000371, CHEBI:1245098, ABP000825, AZ 960-Supplied by Selleck Chemicals, BCP9000348, NCGC00346581-01, KB-74795, X7504, AZ960; AZ-960;905586-69-8, 5-fluoro-2-{[(1S)-1-(4-fluorophenyl)ethyl]amino}-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridine-3-carbonitrile

Molecular Formula: C18H16F2N6Molecular Weight: 354.356646 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: SUNXHXDJOIXABJ-NSHDSACASA-N

• AZD 6482
IUPAC Name: 2-[[(1R)-1-(7-methyl-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)ethyl]amino]benzoic acid | CAS Registry Number: 1173900-33-8
Synonyms: AZD-6482, CHEMBL2165191, AZD6482, (R)-2-(1-(7-methyl-2-morpholino-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl)ethylamino)benzoic acid, PI3-kinase |A inhibitor, AZD6482, 2-[[(1R)-1-[7-Methyl-2-(4-morpholinyl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl]ethyl]amino]benzoic acid, 1173900-33-8, AZD 6482, PI3-kinase |A inhibitor, AZD6482, S1462_Selleck, PubChem19330, SureCN1812377, cc-495, ACT06822, ABP000104, AKOS015935014, BCP9000355, CS-0086, PB13704, RL00654, AZD6482-Supplied by Selleck Chemicals

Molecular Formula: C22H24N4O4Molecular Weight: 408.450360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: IRTDIKMSKMREGO-OAHLLOKOSA-N

• AZD-1480
IUPAC Name: 5-chloro-2-N-[(1S)-1-(5-fluoropyrimidin-2-yl)ethyl]-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine | CAS Registry Number: 935666-88-9
Synonyms: AZD1480, AZD 1480, (S)-5-chloro-N2-(1-(5-fluoropyrimidin-2-yl)ethyl)-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine, 935666-88-9 , AZD 1480, AZD1480, AZD 1480, S2162_Selleck, 2xa4, UNII-KL2Z2TLF01, SureCN3345019, cc-358, QCR-23, CHEMBL1231124, CHEBI:793474, MolPort-016-633-291, BCPP000361, 5-chloro-2-N-[(1S)-1-(5-fluoropyrimidin-2-yl)ethyl]-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine, ABP000832, BCP9000361, AZD1480-Supplied by Selleck Chemicals, NCGC00242486-01

Molecular Formula: C14H14ClFN8Molecular Weight: 348.765963 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: PDOQBOJDRPLBQU-QMMMGPOBSA-N

• AZD-3463
IUPAC Name: N-[4-(4-aminopiperidin-1-yl)-2-methoxyphenyl]-5-chloro-4-(1H-indol-3-yl)pyrimidin-2-amine | CAS Registry Number: 1356962-20-3
Synonyms: AZD3463, ALK/IGF1R inhibitor, SureCN517412, AZD 3463, CS-1382, HY-15609, ALK/IGF1R inhibitor|1356962-20-3|AZD3463|AZD 3463, S7106,1356962-20-3

Molecular Formula: C24H25ClN6OMolecular Weight: 448.947900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: GCYIGMXOIWJGBU-UHFFFAOYSA-N

• AZD-5438
IUPAC Name: 4-(2-methyl-3-propan-2-ylimidazol-4-yl)-N-(4-methylsulfonylphenyl)pyrimidin-2-amine | CAS Registry Number: 602306-29-6
Synonyms: AZD5438, AZD 5438, 4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)-N-(4-(methylsulfonyl)phenyl)pyrimidin-2-amine, AZD-5438, AZD5438, 4-[2-METHYL-1-ISOPROPYL-1H-IMIDAZOL-5-YL]-N-[4-(METHYLSULFONYL)PHENYL]-2-PYRIMIDINAMINE, S2621_Selleck, PubChem19336, SureCN5092360, cc-215, AGN-PC-015B4P, CHEMBL488436, CHEBI:552952, MolPort-008-266-713, BCPP000368, ACN-S001860, ACT06825, AZD5438,AZD 5438, ABP000849, DNC009585, AKOS005145565

Molecular Formula: C18H21N5O2SMolecular Weight: 371.456640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: WJRRGYBTGDJBFX-UHFFFAOYSA-N

• AZD-7762
IUPAC Name: 3-(carbamoylamino)-5-(3-fluorophenyl)-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide | CAS Registry Number: 860352-01-8
Synonyms: AZD7762, AZD 7762, CHEMBL2041933, (S)-5-(3-Fluorophenyl)-N-(piperidin-3-yl)-3-ureidothiophene-2-carboxamide, AZD 7762, AZD7762, S1532_Selleck, SureCN1127614, cc-363, UNII-5D822Y3L1H, QCR-261, MolPort-016-633-230, BCPP000366, RS0027, AKOS005266646, BCP9000356, CS-0025, AZD7762-Supplied by Selleck Chemicals, NCGC00242481-01, NCGC00242481-02, HY-10992

Molecular Formula: C17H19FN4O2SMolecular Weight: 362.421763 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: IAYGCINLNONXHY-LBPRGKRZSA-N


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