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China ShengDa Pharmaceutical Company

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Profile: China ShengDa Pharmaceutical Company is an ISO 14001:2004 & ISO 9001:2000 certified company. Our product line includes tannic acid, tretinoin, minoxidil, dipyridamole, telicoplanin, and calcipotriol. We also offer hydroxypropyl methylcellulose, macromolecule, polyacrylamide, and hydroxyethylcellulose.

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• 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-966492
IUPAC Name: 2-[2-fluoro-4-[(2S)-pyrrolidin-2-yl]phenyl]-1H-benzimidazole-4-carboxamide | CAS Registry Number: 934162-61-5
Synonyms: CHEMBL1090467, SureCN526635, QCR-142, MolPort-028-600-126, BCP9000210, EX-7208, KB-47023, X7570, A24882, A966492, A 966492, 2-[2-Fluoro-4-[(2S)-2-pyrrolidinyl]phenyl]-1H-benzimidazole-7-carboxamide, 2-(2-fluoro-4-((S)-pyrrolidin-2-yl)phenyl)-3H-benzo[d]imidazole-4-carboxamide, 2-(2-fluoro-4-((S)-pyrrolidin-2-yl)phenyl)-3H-benzo[d]imidazole-4-carboxamidef

Molecular Formula: C18H17FN4OMolecular Weight: 324.352183 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: AHIVQGOUBLVTCB-AWEZNQCLSA-N

• A-Cyano-(3,4-dihydroxy)-N-benzylcinnamide
IUPAC Name: (Z)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide | CAS Registry Number: 134036-52-5
Synonyms: AC1NS47P, 2-Cyano-3-(3,4-dihydroxyphenyl)-N-(phenylmethyl)-2-propenamide, CHEMBL1257042, ABP000823, ZINC12352668, AKOS005146338, BRD-K12357156-001-01-5, (Z)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide

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

InChIKey: TUCIOBMMDDOEMM-ZSOIEALJSA-N

• a-D-xylo-Hept-6-enofuranose, 5,6,7-trideoxy-1,2-O-(1-methylethylidene)- (CAS: 546141-37-1)
• Abiraterone
IUPAC Name: (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 154229-19-3
Synonyms: 17-(3-Pyridyl)androsta-5,16-dien-3beta-ol, CB 7598, (3beta)-17-(3-pyridinyl)-androsta-5,16-dien-3-ol, UNII-G819A456D0, CHEBI:68642, CB7598, CB-7598, Androsta-5,16-dien-3-ol, 17-(3-pyridinyl)-, (3beta)-, CB-7598, CB7598, Abiraterone, (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-(pyridin-3-yl)-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol, S1123_Selleck, PubChem20542, SureCN61108, Abiraterone (CB-7598), Abiraterone - CB-7598, AC1L31XF, Androsta-5,16-dien-3-ol, cc-239, CHEMBL254328, CTK8B7779

Molecular Formula: C24H31NOMolecular Weight: 349.509040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GZOSMCIZMLWJML-VJLLXTKPSA-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-263
IUPAC Name: 4-[4-[[2-(4-chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-N-[4-[[(2R)-4-morpholin-4-yl-1-phenylsulfanylbutan-2-yl]amino]-3-(trifluoromethylsulfonyl)phenyl]sulfonylbenzamide | CAS Registry Number: 923564-51-6
Synonyms: Navitoclax, ABT263, ABT 263, Navitoclax [USAN], ABT-263 Navitoclax, ABT-263,Navitoclax, PubChem16672, UNII-XKJ5VVK2WD, Navitoclax (USAN/INN), Navitoclax [USAN:INN], ABT-263 - Navitoclax, cc-344, CTK8E8268, ABP000127, AKOS015896297, RG-7433, RL05817, ABT-263-Supplied by Selleck Chemicals, NCGC00188344-01, NCGC00188344-02

Molecular Formula: C47H55ClF3N5O6S3Molecular Weight: 974.612710 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 14

InChIKey: JLYAXFNOILIKPP-KXQOOQHDSA-N

• ABT-869 (Linifanib)
IUPAC Name: 1-[4-(3-amino-1H-indazol-4-yl)phenyl]-3-(2-fluoro-5-methylphenyl)urea | CAS Registry Number: 796967-16-3
Synonyms: Linifanib, ABT-869, 1-(4-(3-amino-1H-indazol-4-yl)phenyl)-3-(2-fluoro-5-methylphenyl)urea, AL-39324, Kinome_532, S1003_Selleck, ABT 869, ABT869, CHEMBL223360, N-[4-(3-amino-1H-indazol-4-yl)phenyl]-N'-(2-fluoro-5-methylphenyl)urea, RG-3635, ABT869, Linifanib, AL-39324, RG3635, N-(4-(3-Amino-1H-indazol-4-yl)phenyl)-N'-(2-fluoro-5-methylphenyl)urea, N-(4-(3-Amino-1H-indazol-4-yl)phenyl)-N1-(2-fluoro-5-methylphenyl)urea, Urea, N-(4-(3-amino-1H-indazol-4-yl)phenyl)-N'-(2-fluoro-5-methylphenyl)-, 1-[4-(3-amino-1H-indazol-4-yl)phenyl]-3-(2-fluoro-5-methylphenyl)urea, UREA, N-[4-(3-AMINO-1H-INDAZOL-4-YL)PHENYL]-N'-(2-FLUORO-5-METHYLPHENYL)-, Linifanib [USAN], ABT-869,Linifanib, CID11485656

Molecular Formula: C21H18FN5OMolecular Weight: 375.398923 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: MPVGZUGXCQEXTM-UHFFFAOYSA-N

• ABTS
IUPAC Name: azane;3-ethyl-2-[(3-ethyl-6-sulfo-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonic acid | CAS Registry Number: 30931-67-0
Synonyms: AGN-PC-00V7BF, A820659, 2,2'-Azino-di-(3-ethylbenzthiazolinesulphonic acid) diammonium salt, ammonia; 3-ethyl-2-[(3-ethyl-6-sulfo-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonic acid, azane; 3-ethyl-2-[(3-ethyl-6-sulfo-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonic acid, azane;(2Z)-3-ethyl-2-[(Z)-(3-ethyl-6-sulfo-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonic acid

Molecular Formula: C18H24N6O6S4Molecular Weight: 548.679760 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 12

InChIKey: OHDRQQURAXLVGJ-UHFFFAOYSA-N

• AC-DEVD-AMC
IUPAC Name: 4-[(2-acetamido-3-carboxypropanoyl)amino]-5-[[1-[[3-carboxy-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid | CAS Registry Number: 169332-61-0
Synonyms: CPP32/Apopain Substrate, Ac-Asp-Glu-Val-Asp-AMC, ICE SUBSTRATE, AC1L1CON, AMC138, ICE (CASPASE I) SUBSTRATE, Ac-Asp-Glu-Val-Asp-7-Amino-4-Methylcoumarin, 4-[(2-acetamido-4-hydroxy-4-oxobutanoyl)amino]-5-[[1-[[4-hydroxy-1-[(4-methyl-2-oxochromen-7-yl)amino]-1,4-dioxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid

Molecular Formula: C30H37N5O13Molecular Weight: 675.640480 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 13

InChIKey: ALZSTTDFHZHSCA-UHFFFAOYSA-N

• AC-DEVD-PNA (CAS: 189950-66-1)
• Ac-IETD-pNA
• AC-IETD-SSNA (CAS: 219138-21-3)
• Acetic Acid, 2-[[4-Chloro-6-[(2,3-Dimethylphenyl)amino]-2-Pyrimidinyl]thio]-
IUPAC Name: 2-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanylacetic acid | CAS Registry Number: 50892-23-4
Synonyms: Pirinixic acid, WY-14643, [4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthio]acetic acid, WY-14,643, Wyeth 14,643, WY14643, Pirinixic acid [INN], (4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthio)acetic acid, NSC310038, Wy 14643, NSC-310038, UNII-86C4MRT55A, CCRIS 133, Acide pirinixique [INN-French], Acido pirinixico [INN-Spanish], Acidum pirinixicum [INN-Latin], CHEBI:32509, IN1417, NSC 310038, 4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthioacetic acid

Molecular Formula: C14H14ClN3O2SMolecular Weight: 323.797860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: SZRPDCCEHVWOJX-UHFFFAOYSA-N

• AG 490; (E)-2-CYANO-3-(3,4-DIHYDROPHENYL)-N-BENZYL-2-PRO PENAMIDE
IUPAC Name: (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide | CAS Registry Number: 133550-30-8
Synonyms: Tyrphostin B42, Tyrphostin AG 490, AG-490, AG 490, AG490, (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)acrylamide, Tyrphostin AG490, alpha-Cyano-(3,4-dihydroxy)-N-benzylcinnamide, SBB063097, AG-490 , 133550-30-8, (2E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide, (2E)-2-CYANO-3-(3,4-DIHYDROXYPHENYL)-N-(PHENYLMETHYL)-2-PROPENAMIDE, AG490, Tyrphostin AG490, AG-490, Tyrphostin,AG490, N-Benzyl-3,4-dihydroxy-alpha-cyanocinnamide, S1143_Selleck, Tocris-0414, Tyrphostin deriv. 42, AC1NS5BM, BiomolKI_000025

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

InChIKey: TUCIOBMMDDOEMM-RIYZIHGNSA-N

• AG-14699
Synonyms: Rucaparib phosphate, AG-014699, PF-01367338, AG 014699 phosphate, AG-014699 phosphate, PF01367338 phosphate, AG014699, PF 01367338 phosphate, PF-01367338 phosphate, AG 014699, AG-014447, AG-14447, Rucaparib, PF-01367338, AG-014447, 459868-92-9, PubChem22411, AGN-PC-0MVW3C, cc-55, Rucaparib AG 014699, SureCN844872, Rucaparib phosphate (USAN), AG-014699 - Rucaparib

Molecular Formula: C19H21FN3O5PMolecular Weight: 421.359305 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 7

InChIKey: FCCGJTKEKXUBFZ-UHFFFAOYSA-N

• AG-L-59687
IUPAC Name: 2-[8-[2-amino-6-[(4-bromothiophen-2-yl)methoxy]purin-9-yl]octoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 793035-88-8
Synonyms: AGN-PC-075KWF, CTK5E6665, MolPort-023-219-164, AKOS015995231, BCP9000247, BCP0726000121, Y0370, S-7788, 8-{2-Amino-6-[(4-bromo-2-thienyl)methoxy]-9H-purin-9-yl}octyl hexopyranoside, (2S,4R,5S)-2-[8-[2-amino-6-[(4-bromothiophen-2-yl)methoxy]purin-9-yl]octoxy]-6-(hydroxymethyl)oxane-3,4,5-triol, 2-{8-[2-Amino-6-(4-bromo-thiophen-2-ylmethoxy)-purin-9-yl]-octyloxy}-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol

Molecular Formula: C24H34BrN5O7SMolecular Weight: 616.525060 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 12

InChIKey: WAAZBVOGWRQLMB-UHFFFAOYSA-N

• AGI-5198
IUPAC Name: N-cyclohexyl-2-(3-fluoro-N-[2-(2-methylimidazol-1-yl)acetyl]anilino)-2-(2-methylphenyl)acetamide | CAS Registry Number: 1355326-35-0
Synonyms: AGI5198, AGI 5198, IDH C35, CHEMBL2180727, AGN-PC-0BFAXD, QCR-214, MolPort-028-600-026, CS-1429, NCGC00347934-01, HY-18082, AB0032505, KB-308402, W-6035, S900006220, N-cyclohexyl-2-(3-fluoro-N-[2-(2-methylimidazol-1-yl)acetyl]anilino)-2-(2-methylphenyl)acetamide, N-cyclohexyl-2-(N-(3-fluorophenyl)-2-(2-methyl-1H-imidazol-1-yl)acetamido)-2-o-tolylacetamide

Molecular Formula: C27H31FN4O2Molecular Weight: 462.559043 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: FNYGWXSATBUBER-UHFFFAOYSA-N

• Agomelatine
IUPAC Name: N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide | CAS Registry Number: 138112-76-2
Synonyms: Valdoxan, Thymanax, Melitor, S20098, Valdoxan (TN), Agomelatine (INN), Agomelatine [INN], N-(2-(7-Methoxynaphthalen-1-yl)ethyl)acetamide, S1243_Selleck, AGO-178, N-(2-(7-Methoxynaphth-1-yl)ethyl)acetamide, N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide, S 20098, S-20098, AC1L32UM, CHEMBL10878, UNII-137R1N49AD, N-(2-(7-methoxy-1-naphthyl)ethyl)acetamide, C15H17NO2, CHEBI:108209

Molecular Formula: C15H17NO2Molecular Weight: 243.300980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YJYPHIXNFHFHND-UHFFFAOYSA-N

• Alcaftadine
IUPAC Name: 11-(1-methylpiperidin-4-ylidene)-5,6-dihydroimidazo[2,1-b][3]benzazepine-3-carbaldehyde | CAS Registry Number: 147084-10-4
Synonyms: Lastacaft, R-89674, UNII-7Z8O94ECSX, CHEBI:71023, R89674, R 89674, alcaftadina, alcaftadinum, Lastacaftreg, Vilasta, Lastacaft (TN), Alcaftadine (USAN/INN), Alcaftadine [USAN:INN], AGN-PC-02C8CN, 7Z8O94ECSX, GTPL7587, CHEMBL1201747, MolPort-023-219-144, AM84429, BCP9000269

Molecular Formula: C19H21N3OMolecular Weight: 307.389540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MWTBKTRZPHJQLH-UHFFFAOYSA-N

• Almitrine Bismesylate
IUPAC Name: 6-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine;methanesulfonic acid | CAS Registry Number: 29608-49-9
Synonyms: Almitrine mesylate, Almitrine bismesylate, Almitrine dimethanesulfonate, Almitrine dimesilate, Almitrine dimesylate, Vectarion (TN), AC1OCFKE, PubChem20474, 2,4-Bis(allylamino)-6-(4-(bis(p-fluorophenyl)methyl)-1-piperazinyl)-s-triazine dimethanesulfonate, 6-(4-(Bis(4-fluorophenyl)methyl)-1-piperazinyl)-N,N'-di-2-propenyl-1,3,5-triazine-2,4-diamine dimethanesulfonate, 6-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine; methanesulfonic acid, Almitrine mesylate (USAN), DSSTox_CID_31492, DSSTox_RID_97377, DSSTox_GSID_57703, CHEBI:53779, Tox21_113959, NCGC00262968-01, CAS-29608-49-9, D02822

Molecular Formula: C28H37F2N7O6S2Molecular Weight: 669.763486 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 15

InChIKey: MRDBGMJEPGXQHJ-UHFFFAOYSA-N

• Almitrine Bismesylate INN
• Alogliptin
IUPAC Name: 2-[[6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile;benzoic acid | CAS Registry Number: 850649-62-6
Synonyms: Alogliptin benzoate, Nesina, SYR 322, SYR-322, UNII-EEN99869SC, CHEBI:72324, Vipidia (TN), alogliptin monobenzoate, SureCN476231, cc-281, CHEMBL227529, EEN99869SC, Alogliptin benzoate (JAN/USAN), HY-A0023, AC-021, AKOS015917686, CS-0761, AB1008522, AM20090704, FT-0686730

Molecular Formula: C25H27N5O4Molecular Weight: 461.512980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: KEJICOXJTRHYAK-XFULWGLBSA-N

• ALOGLIPTIN(ALOGLIPTINE, ALOGLIPTINA)
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: Alogliptin, 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

• alpha-Cyclopentylmandelic acid
IUPAC Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid | CAS Registry Number: 427-49-6
Synonyms: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid, Cyclopentylphenylglycolic acid, cyclopentyl(hydroxy)phenylacetic acid, Cyclopentyl-hydroxy-phenyl-acetic acid, alpha-Cyclopentyl-DL-mandelic Acid, Cyclopentyl Mandelic Acid, SureCN415801, AC1Q5SN2, Oprea1_794057, MLS000036193, AGN-PC-0C3A40, Mandelic acid, alpha-cyclopentyl, CTK7I4201, MolPort-001-011-703, BB_SC-6078, HMS2321I07, ST039, AC1L4020, ACT03336, NSC96637

Molecular Formula: C13H16O3Molecular Weight: 220.264340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WFLUEQCOAQCQLP-UHFFFAOYSA-N

• Alvespimycin
IUPAC Name: [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-21-[2-(dimethylamino)ethylamino]-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 | CAS Registry Number: 467214-20-6
Synonyms: alvespimycin, 17-DMAG, KOS-1022, NSC707545, 17-(dimethylaminoethylamino)-17-demethoxygeldanamycin, KOS1022, KOS 1022, Alvespimycin [INN], DMAG, AC1NRBWB, SureCN5449716, UNII-001L2FE0M3, CHEMBL383824, 17-dimethylaminoethylamino-17-demethoxygeldanamycin, ABP000223, CS-0912, ((4E,6Z,8S,9S,10E,12S,13R,14S,16R)-19-(2-dimethylaminoethylamino)-13-hydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-2-azabicyclo(16.3.1)docosa-4,6,10,18,21-pentaen-9-yl) carbamate, HY-10389, X8446, 150270-08-9

Molecular Formula: C32H48N4O8Molecular Weight: 616.745520 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 10

InChIKey: KUFRQPKVAWMTJO-LMZWQJSESA-N

• AM 630
IUPAC Name: [6-iodo-2-methyl-1-(2-morpholin-4-ylethyl)indol-3-yl]-(4-methoxyphenyl)methanone | CAS Registry Number: 164178-33-0
Synonyms: AM-630, AM630, (6-iodo-2-methyl-1-(2-morpholinoethyl)-1H-indol-3-yl)(4-methoxyphenyl)methanone, CHEMBL181633, iodopravadoline, [6-iodo-2-methyl-1-(2-morpholin-4-ylethyl)indol-3-yl]-(4-methoxyphenyl)methanone, 6-iodopravadoline, S1543_Selleck, Tocris-1120, AC1N7ICI, AM 630;Iodopravadoline;, AGN-PC-0L8U9C, SureCN2545822, GTPL750, CTK0I0704, MolPort-003-983-508, BCPP000412, HMS3267M04, ABP000810, ANW-45821

Molecular Formula: C23H25IN2O3Molecular Weight: 504.360670 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JHOTYHDSLIUKCJ-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

• AMG900
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, AMG-900, 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

• Amonafide
IUPAC Name: 5-amino-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione | CAS Registry Number: 69408-81-7
Synonyms: Nafidimide, Quinamed, Xanafide, Benzisoquinolinedione, Amonifide, 5-Aminomitonafide, NSC308847, Amonafidum [Latin], NSC-308847, Amonafida [Spanish], AS-1413, MLS000757039, M-FA 142, M-FA-142, AS1413, FA 142, NSC 308847, BRN 5344673, AS-1413(Amonafide), AS1413, Xanafide, Quinamed, 69408-81-7

Molecular Formula: C16H17N3O2Molecular Weight: 283.325080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: UPALIKSFLSVKIS-UHFFFAOYSA-N

• Amrubicin
IUPAC Name: (7S,9S)-9-acetyl-9-amino-7-[(2S,4R,5R)-4,5-dihydroxyoxan-2-yl]oxy-6,11-dihydroxy-8,10-dihydro-7H-tetracene-5,12-dione | CAS Registry Number: 110267-81-7
Synonyms: SureCN10061868, (7S,9S)-9-Acetyl-9-amino-7-[(2-deoxy-|A-D-erythro-pentopyranosyl)oxy]-7,8,9,10-tetrahydro-6,11-dihydroxy-5,12-naphthacenedione

Molecular Formula: C25H25NO9Molecular Weight: 483.467300 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: VJZITPJGSQKZMX-JKTZVLKLSA-N

• Amsilarotene
IUPAC Name: 4-[[3,5-bis(trimethylsilyl)benzoyl]amino]benzoic acid | CAS Registry Number: 125973-56-0
Synonyms: TAC-101, UNII-Q1418F39MH, Benzoic acid, 4-((3,5-bis(trimethylsilyl)benzoyl)amino)-, Benzoic acid, 4-[[3,5-bis(trimethylsilyl)benzoyl]amino]-, Am 555S, Am-555S, TAC 101, Amsilarotene [INN], AGN-PC-0MTQ8F, SureCN1133175, 4-(3,5-bis(trimethylsilyl)benzamido)benzoic acid, CHEMBL32994, CCRIS 9419, Q1418F39MH, DA-13333, 4-(3,5-Bis(trimethylsilyl)benzamido) benzoic acid

Molecular Formula: C20H27NO3Si2Molecular Weight: 385.604280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: VVTNSTLJOVCBDL-UHFFFAOYSA-N

• Anamorelin
IUPAC Name: 2-amino-N-[(2R)-1-[(3R)-3-benzyl-3-[dimethylamino(methyl)carbamoyl]piperidin-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-methylpropanamide | CAS Registry Number: 249921-19-5
Synonyms: ONO7643, ONO 7643, ONO-7643, RC1291, RC 1291, UNII-DD5RBA1NKF, DD5RBA1NKF, SureCN935751, DCL000049, CS-1036, HY-14734, AB0165721, W-5500

Molecular Formula: C31H42N6O3Molecular Weight: 546.703580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: VQPFSIRUEPQQPP-MXBOTTGLSA-N

• Anidulafungin
Synonyms: Eraxis, Ecalta, V-Echinocandin, UNII-9HLM53094I, CHEBI:55346, AC1L4YAI, Anidulafungin [USAN:INN], VER-002, DB00362, LS-63738, LY-303366, (4R,5R)-4,5-Dihydroxy-N(sup 2)-((4'-(pentyloxy)-p-terphenyl-4-yl)carbonyl)-L-ornithyl-L-threonyl-trans-4-hydroxy-L-prolyl-(S)-4-hydroxy-4-(p-hydroxyphenyl)-L-threonyl-L-threonyl-(3S,4S)-3-hydroxy-4-methyl-L-proline cyclic (6-1)-peptide, Echinocandin B, 1-((4R,5R)-4,5-dihydroxy-N(sup 2)-((4'-(pentyloxy)(1,1':4',1'-terphenyl)-4-yl)carbonyl)-L-ornithine)-, Echinocandin B, 1-((4R,5R)-4,5-dihydroxy-N2-((4"-(pentyloxy)(1,1':4',1"-terphenyl)-4-yl)carbonyl)-L-ornithine), N-{(2R,6S,9S,11R,12R,14aS,15S,16S,20S,23S,25aS)-23-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-2,11,12,15-tetrahydroxy-6,20-bis[(1R)-1-hydroxyethyl]-16-methyl-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl}-4''-(pentyloxy)-1,1':4',1''-terphenyl-4-carboxamide, Anidulafungina, Anidulafungine, Anidulafunginum, CID166548, CHEMBL264241

Molecular Formula: C58H73N7O17Molecular Weight: 1140.236920 [g/mol]
H-Bond Donor: 14H-Bond Acceptor: 17

InChIKey: JHVAMHSQVVQIOT-MFAJLEFUSA-N

• AP24534
IUPAC Name: 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide | CAS Registry Number: 943319-70-8
Synonyms: PONATINIB, Iclusig, AP-24534, AP-24534, Ponatinib, AP24534, AP 24534, UNII-4340891KFS, 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide, 3-(2-(Imidazo[1,2-b]pyridazin-3-yl)ethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide, BENZAMIDE, 3-(2-IMIDAZO[1,2-B]PYRIDAZIN-3-YLETHYNYL)-4-METHYL-N-[4-[(4-METHYL-1-PIPERAZINYL)METHYL]-3-(TRIFLUOROMETHYL)PHENYL]-, 0LI, 3-(Imidazo[1,2-B]pyridazin-3-Ylethynyl)-4-Methyl-N-{4-[(4-Methylpiperazin-1-Yl)methyl]-3-(Trifluoromethyl)phenyl}benzamide, S1490_Selleck, AP24534,Ponatinib, Ponatinib (USAN/INN), Ponatinib [USAN:INN], AP24534 - Ponatinib, Ponatinib (AP24534), SureCN589260, QCR-6, cc-191

Molecular Formula: C29H27F3N6OMolecular Weight: 532.559490 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: PHXJVRSECIGDHY-UHFFFAOYSA-N

• APOPTOSIS ACTIVATOR 2
IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]indole-2,3-dione | CAS Registry Number: 79183-19-0
Synonyms: 1-(3,4-Dichlorobenzyl)-1H-indole-2,3-dione, Apoptosis Activator II, Apoptosis Activator 2, AG-H-17727, 1-[(3,4-dichlorophenyl)methyl]indole-2,3-dione, ZINC02276110, AC1LYJSJ, Tocris-2098, AC1Q3JHQ, CBMicro_042945, Isatin-based compound, 16, SureCN5426477, cc-650, Bio-0876, CHEMBL375126, CTK5E6556, MolPort-002-181-853, HMS3268L07, DNC007179, HSCI1_000276

Molecular Formula: C15H9Cl2NO2Molecular Weight: 306.143460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KGRJPLRFGLMQMV-UHFFFAOYSA-N

• Aprepitant
IUPAC Name: 5-[[(2R,3S)-2-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one | CAS Registry Number: 170729-80-3
Synonyms: KB-47430

Molecular Formula: C23H21F7N4O3Molecular Weight: 534.426662 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 11

InChIKey: ATALOFNDEOCMKK-IWSJWDQHSA-N

• ARN-509
IUPAC Name: 4-[7-[6-cyano-5-(trifluoromethyl)pyridin-3-yl]-8-oxo-6-sulfanylidene-5,7-diazaspiro[3.4]octan-5-yl]-2-fluoro-N-methylbenzamide | CAS Registry Number: 956104-40-8
Synonyms: ARN509, UNII-4T36H88UA7, ARN 509, Benzamide, 4-[7-[6-cyano-5-(trifluoromethyl)-3-pyridinyl]-8-oxo-6-thioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-methyl-, 4-(7-(6-Cyano-5-(trifluoromethyl)pyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspiro(3.4)octan-5-yl)-2-fluoro-N-methylbenzamide, 4-(7-(6-CYANO-5-(TRIFLUOROMETHYL)PYRIDIN-3-YL)-8-OXO-6-THIOXO-5,7-DIAZASPIRO[3.4]OCTAN-5-YL)-2-FLUORO-N-METHYLBENZAMIDE, AGN-PC-04T0IN, cc-670, QCR-211, MolPort-027-720-961, 4T36H88UA7, AMX10207, CS-0885, PB27306, RL06020, NCGC00346725-01, HY-16060, AB0008189, Y0375, W-5908

Molecular Formula: C21H15F4N5O2SMolecular Weight: 477.434713 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: HJBWBFZLDZWPHF-UHFFFAOYSA-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-520
IUPAC Name: (2S)-2-(3-aminopropyl)-5-(2,5-difluorophenyl)-N-methoxy-N-methyl-2-phenyl-1,3,4-thiadiazole-3-carboxamide

Molecular Formula: C20H22F2N4O2SMolecular Weight: 420.476086 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: LLXISKGBWFTGEI-FQEVSTJZSA-N

• ARRY-543 (CAS: 114629-86-8)
• 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

• AS703569(R763)
• ASC-J9
IUPAC Name: (1E,4Z,6E)-1,7-bis(3,4-dimethoxyphenyl)-5-hydroxyhepta-1,4,6-trien-3-one | CAS Registry Number: 917813-54-8
Synonyms: Dimethylcurcumin, 1,7-Bis-(3,4-dimethoxyphenyl)-5-hydroxy-hepta-1,4,6-trien-3-one, ASC J9, UNII-D60XLY608D, CHEMBL128748, GO Y025, 52328-98-0, Curcumin dimethyl ether, ASCJ-9, AC1O53VS, Go-Y025, D60XLY608D, MolPort-023-278-636, GO-Y-025, NSC734923, RSC004738, AKOS015891371, CS-0533, LS40141, NSC-734923

Molecular Formula: C23H24O6Molecular Weight: 396.433060 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: ZMGUKFHHNQMKJI-CIOHCNBKSA-N

• Ascomycin
Synonyms: ascomycin, FK520, Immunomycin, FK-520, FR-900520, FR900520, FK 520, FR 900520, Ascomycin (FK520, L-683590, SureCN25512, CHEMBL8597, BSPBio_001318, MolPort-020-005-846, HMS1361B20, HMS1791B20, HMS1989B20, AKOS015916691, CS-1516, IDI1_033788

Molecular Formula: C43H69NO12Molecular Weight: 792.007460 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 12

InChIKey: ZDQSOHOQTUFQEM-NURRSENYSA-N

• Ascomycin [fk-520]
Synonyms: ascomycin, SureCN386169, AC1L1D8L, AGN-PC-0140P9, CTK8E7561, 104987-12-4, AG-D-18046, 15,19-Epoxy-3H-pyrido[2,1-c][1,4]oxaazacyclotricosine-1,7,20,21(4H,23H)-tetrone,8-ethyl-5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-5,19-dihydroxy-3-[2-(4-hydroxy-3-methoxycyclohexyl)-1-methylethenyl]-14,16-dimethoxy-4,10,12,18-tetramethyl-,[3S-[3R*[E(1S*,3S*,4S*)],4S*,5R*,8S*,9E,12R*,14R*,15S*,16R*,18S*,19S*,26aR*]]-;Immunomycin;Changchuanmycin;FK 520;FR 520;FR 900520;(3S,4R,5S,8R,12S,14S,15R,16S,18R,19R,26aS)-8-Ethyl-5,19-dihydroxy-3-{(E)-2-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]-1-methylethenyl}-14,16-dimethoxy-4,10,12,18-tetramethyl-5,6,8,11,12,13,14,15,16,17 ,18,19,24,25,26,26a-hexadecahydro-3H-15,19-epoxypyrido[2,1-c][1,4]oxazacyclotricosine-1,7,20,21(4H,23H)-tetrone;L 683590;

Molecular Formula: C43H69NO12Molecular Weight: 792.007460 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 12

InChIKey: ZDQSOHOQTUFQEM-UHFFFAOYSA-N

• Asenapine
Synonyms: SureCN8008417

Molecular Formula: C17H16ClNOMolecular Weight: 285.768040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VSWBSWWIRNCQIJ-MLCCFXAWSA-N

• ASP
• ASP3026
IUPAC Name: 2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine | CAS Registry Number: 1097917-15-1
Synonyms: ASP-3026, UNII-HP4L6MXF10, 2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine, N2-[2-Methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-1,3,5-triazine-2,4-diamine, AGN-PC-04WZBO, SureCN2827739, HP4L6MXF10, cc-325, GTPL7740, QCR-144, ASP 3026, CS-0787, RL00420, NCGC00345791-01, HY-13326, AB0095023, W-5854

Molecular Formula: C29H40N8O3SMolecular Weight: 580.744700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 11

InChIKey: MGGBYMDAPCCKCT-UHFFFAOYSA-N

• AT-406 (CAS: 1071992-57-8)

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