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Topharman Shanghai Co Ltd

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Web: http://www.topharman.com
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Address: Building 1, No.388 Jialilue Road, Zhangjiang Hitech Park, Pudong, Shanghai 201203, China
Phone: +86-(21)-61090366 | Fax: +86-(21)-61090376 | Map/Directions >>

Profile: Topharman Shanghai Co Ltd manufactures active pharmaceutical intermediates. Our product includes bumetanide, adapalene, ambazone, aminocarb, antazolin, bicifadine and delavirdine. We also provide doxazosin, exalamide, fenoxazoline, fluoxetine, tegaserod, zaleplon and zoledronic acid.

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• 1-[1-(4-Chloropyenyl)cyclobutyl]-3-Methylbutylamine
IUPAC Name: 1-[1-(4-chlorophenyl)cyclobutyl]-3-methylbutan-1-amine | CAS Registry Number: 84467-54-9
Synonyms: N-Didesmethylsibutramine, 1-[1-(4-chlorophenyl)cyclobutyl]-3-methylbutan-1-amine, Didemethylsibutramine, didesmethylsibutramine, Didesmethyl Sibutramine, N-Didemethylsibutramine, SureCN682189, (+/-)-Didesmethylsibutramine, AC1L357N, CYC007, CTK7D4257, AKOS015962045, AG-A-16638, SEP-225289, (1-(4-Chlorophenyl)cyclobutyl)-3-methylbutylamine, A840793, 1-[1-(4-Chlorophenyl)cyclobutyl]-3-methylbutylamine, 1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-1-butanamine, 1-[1-(4-chlorophenyl)cyclobutyl]-3-methyl-butan-1-amine, 1-(4-Chlorophenyl)-|A-(2-methylpropyl)cyclobutanemethanamine

Molecular Formula: C15H22ClNMolecular Weight: 251.794880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WQSACWZKKZPCHN-UHFFFAOYSA-N

• 2-(Chloromethyl)-2-imidazoline
IUPAC Name: 2-(chloromethyl)-4,5-dihydro-1H-imidazole | CAS Registry Number: 50342-08-0
Synonyms: 2-(CHLOROMETHYL)-2-IMIDAZOLINE, 2-CHLOROMETHYLIMIDAZOLINE, 2-(chloromethyl)-4,5-dihydro-1H-imidazole, AC1L8HD0, SureCN1001560, IMI006, CHEBI:53552, CTK4J2467, MolPort-001-783-568, ALBB-015071, AKOS003587374, AG-F-69182, KB-163329, 1H-Imidazole, 2-(chloromethyl)-4,5-dihydro-, 2-(CHLOROMETHYL)-4,5-DIHYDROIMIDAZOLE

Molecular Formula: C4H7ClN2Molecular Weight: 118.564780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YFBPRBZDQSMTKG-UHFFFAOYSA-N

• 4-THIAZOLEACETIC ACID2-AMINO-A-(HYDROXYIMINO)
IUPAC Name: (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetic acid | CAS Registry Number: 120570-48-1
Synonyms: 2-Athiaa, HcOL`LKiWPBLdTQTRfUSLttBF`, MolPort-005-935-454, AC-5561, CID6399474, 2-(2-Aminothiazole-4-yl)-2-hydroxyiminoacetic acid, I09-0232, 4-Thiazoleacetic acid, 2-amino-alpha-(hydroxyimino)-, 2-(2-Amino-1,3-thiazolyl-4-yl)-2-hydroxyiminoacetic acid

Molecular Formula: C5H5N3O3SMolecular Weight: 187.176500 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: URGSBEYHHRKMJL-BAQGIRSFSA-N

• 1-(2,6-DICHLOROPHENYL)-1,3-DIHYDRO-5-HYDROXY-2H-INDOL-2-ONE
IUPAC Name: 1-(2,6-dichlorophenyl)-5-hydroxy-3H-indol-2-one | CAS Registry Number: 30267-40-4
Synonyms: SureCN9525943, IND010, CTK4G4754, AG-E-99224, KB-212694, A820283, 1-(2,6-dichlorophenyl)-5-hydroxy-3H-indol-2-one, 1-[2,6-bis(chloranyl)phenyl]-5-oxidanyl-3H-indol-2-one, 2-Indolinone,1-(2,6-dichlorophenyl)-5-hydroxy- (8CI);, 2H-Indol-2-one, 1-(2,6-dichlorophenyl)-1,3-dihydro-5-hydroxy-, 2H-Indol-2-one,1-(2,6-dichlorophenyl)-1,3-dihydro-5-hydroxy-

Molecular Formula: C14H9Cl2NO2Molecular Weight: 294.132760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RPECVEMYMBMRRZ-UHFFFAOYSA-N

• 5-NITRO-3-FURANCARBOXYLIC ACID
IUPAC Name: 5-nitrofuran-3-carboxylic acid | CAS Registry Number: 770-07-0
Synonyms: 3-Furancarboxylic acid, 5-nitro-, AG-H-07599, FUR004, CTK2H6907, 3-Furoicacid, 5-nitro- (7CI,8CI);5-Nitro-3-furancarboxylic acid;

Molecular Formula: C5H3NO5Molecular Weight: 157.081020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RYJMQGMUCNUWMK-UHFFFAOYSA-N

• 3-NITRO-4-(CYCLOHEXYLAMINO) BENZOIC ACID METHYL ESTER
IUPAC Name: methyl 4-(cyclohexylamino)-3-nitrobenzoate | CAS Registry Number: 503859-26-5
Synonyms: methyl 4-(cyclohexylamino)-3-nitrobenzoate, methyl 4-(cyclohexylamino)-3-nitrobenzenecarboxylate, ST4093334, Benzoic acid, 4-(cyclohexylamino)-3-nitro-, methyl ester, ZINC04622301, ACMC-209klx, AC1MH7W4, SureCN5065370, BEN147, CTK4J2558, MolPort-002-288-866, ANW-30979, STK226847, AKOS003355781, AG-F-69439, MB03040, MCULE-4050011478, RP15394, methylcyclohexylaminonitrobenzenecarboxylate, KB-256781

Molecular Formula: C14H18N2O4Molecular Weight: 278.303720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RKLPKKOKDXVKFJ-UHFFFAOYSA-N

• 2-Chloro-3-nitroanisole
IUPAC Name: 2-chloro-1-methoxy-3-nitrobenzene | CAS Registry Number: 3970-39-6
Synonyms: 2-chloro-1-methoxy-3-nitrobenzene, Benzene, 2-chloro-1-methoxy-3-nitro-, 2-CHLORO-3-NITROANISOLE, 2-chloro-1-methoxy-3-nitro-Benzene, AG-F-40296, AN-584/43422712, PubChem19263, SureCN2496089, KSC497M8H, CTK3J7683, MolPort-009-014-663, 2-chloro-3-methoxy-1-nitrobenzene, ANW-51780, SBB090640, ZINC21304512, AKOS006308574, AS02825, PB22450, RP24750, AK-24862

Molecular Formula: C7H6ClNO3Molecular Weight: 187.580440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XVBAPYDWAVGVGW-UHFFFAOYSA-N

• 2,4,5-TrimethoxyBenzaldehyde
IUPAC Name: 2,4,5-trimethoxybenzaldehyde | CAS Registry Number: 4460-86-0
Synonyms: Asaronaldehyde, Asaraldehyde, Azarylaldehyde, Gazarin, Asarylaldehyde, 2,4,5-TRIMETHOXYBENZALDEHYDE, Spectrum_000818, 3,4,6-Trimethoxybenzaldehyde, Benzaldehyde, 2,4,5-trimethoxy-, Spectrum2_000386, Spectrum3_000170, Spectrum4_001759, Spectrum5_000618, CCRIS 1296, BSPBio_001639, KBioGR_002238, KBioSS_001298, SPECTRUM200208, HSDB 4502, SPBio_000571

Molecular Formula: C10H12O4Molecular Weight: 196.199880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: IAJBQAYHSQIQRE-UHFFFAOYSA-N

• (-)-Sparteine
Synonyms: Sparteine, lupinidine, Lupinidin, Spartein, (-)-Lupinidine, L-SPARTEINE, Prestwick_426, Sparteine (-), Prestwick3_000618, Sparteine (6CI,8CI), BSPBio_000556, MLS000028889, BPBio1_000612, CHEBI:28827, 6beta,7alpha,9alpha,11alpha-Pachycarpine, NCGC00142614-01, SMR000059203, TL8005816, 6-beta,7-alpha,9-alpha,11-alpha-Pachycarpine, C10783

Molecular Formula: C15H26N2Molecular Weight: 234.380340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SLRCCWJSBJZJBV-ZQDZILKHSA-N

• 3(2H)-PYRIDAZINONE,4,5-DIHYDRO-6-(ISOPROPYL)-
IUPAC Name: 3-propan-2-yl-4,5-dihydro-1H-pyridazin-6-one | CAS Registry Number: 210230-80-1
Synonyms: 4,5-DIHYDRO-6-(1-METHYLETHYL)-3(2H)-PYRIDAZINONE, SureCN3345980, PYR065, KB-188061, 3(2H)-Pyridazinone, 4,5-dihydro-6-(1-methylethyl)-

Molecular Formula: C7H12N2OMolecular Weight: 140.182980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CWCDVJSJBVFNJK-UHFFFAOYSA-N

• 4-THIAZOLEETHANETHIOIC ACID
IUPAC Name: S-(1,3-benzothiazol-2-yl) (2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoethanethioate | CAS Registry Number: 94088-75-2
Synonyms: MolPort-003-930-827, EINECS 302-077-9, ZINC02149439, ZINC02149443, CID5492744, I06-0470, S-Benzothiazol-2-yl 2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)thioacetate

Molecular Formula: C13H10N4O2S3Molecular Weight: 350.439100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: COFDRZLHVALCDU-LICLKQGHSA-N

• 3-Aminobenzenesulphinamide
IUPAC Name: 3-aminobenzenesulfonamide | CAS Registry Number: 98-18-0
Synonyms: Metanilamide, Metaniilamide, m-Sulfamoylaniline, m-Aminobenzenesulfonamide, 3-Aminosulfonylaniline, m-Aminobenzenesulphonamide, Benzenesulfonamide, m-amino-, Benzenesulfonamide, 3-amino-, 3-AMINOBENZENESULFONAMIDE, NSC 7542, EINECS 202-646-0, NSC7542, AIDS019102, AIDS-019102, BRN 0511851, ZINC03874012, SDCCGMLS-0066234.P001, LS-89886, ST5406779, 4-14-00-02648 (Beilstein Handbook Reference)

Molecular Formula: C6H8N2O2SMolecular Weight: 172.204920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: JPVKCHIPRSQDKL-UHFFFAOYSA-N

• 2-Chloro-3-nitrophenol
IUPAC Name: 2-chloro-3-nitrophenol | CAS Registry Number: 603-84-9
Synonyms: Phenol, 2-chloro-3-nitro-

Molecular Formula: C6H4ClNO3Molecular Weight: 173.553860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QBGLHYQUZJDZOO-UHFFFAOYSA-N

• 2-Chloro-4-hydrazinopyridine
IUPAC Name: (2-chloropyridin-4-yl)hydrazine | CAS Registry Number: 700811-29-6
Synonyms: 2-chloro-4-hydrazinylpyridine, AG-G-73496, PubChem19455, Pyridine,2-chloro-4-hydrazino, PYR121, (2-chloro-4-pyridinyl)hydrazine, CTK5D1787, Pyridine,2-chloro-4-hydrazinyl-, (2-chloranylpyridin-4-yl)diazane, MolPort-004-756-183, Pyridine, 2-chloro-4-hydrazino-, ANW-51761, WT1965, ZINC21982252, AKOS006290211, AC-5764, QC-3356, AK-24894, AM804250, BL010284

Molecular Formula: C5H6ClN3Molecular Weight: 143.574240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: YCFQPRVUXPTFON-UHFFFAOYSA-N

• 4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONE,2-AMINO-3,5-DIHYDRO-3-[(PHENYLMETHOXY)METHYL]-
IUPAC Name: 2-amino-3-(phenylmethoxymethyl)-5H-pyrrolo[3,2-d]pyrimidin-4-one | CAS Registry Number: 518316-55-7
Synonyms: PYR099, 4H-Pyrrolo[3,2-d]pyrimidin-4-one, 2-amino-3,5-dihydro-3-[(phenylmethoxy)methyl]-

Molecular Formula: C14H14N4O2Molecular Weight: 270.286560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: RERCCUSVCCXBNQ-UHFFFAOYSA-N

• 2-Bromo-3-Bromomethylthiophene
IUPAC Name: 2-bromo-3-(bromomethyl)thiophene | CAS Registry Number: 40032-76-6
Synonyms: 2-Bromo-3-bromomethylthiophene, 2-bromo-3-(bromomethyl)thiophene, AG-F-41531, Thiophene, 2-bromo-3-(bromomethyl)-, ZINC02577988, ACMC-1APZA, AC1MC3JD, SureCN725380, THI025, 2-Bromo-3-bromomethyl-thiophene, CTK4I2305, MolPort-001-770-522, ANW-54523, Thiophene,2-bromo-3-(bromomethyl)-, AKOS015835995, PB14291, QC-6115, AK-81625, KB-21147, A6690

Molecular Formula: C5H4Br2SMolecular Weight: 255.958260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZPWPMAAPQZXPDD-UHFFFAOYSA-N

• 7-[4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butoxy]-2(1H)-quinolinone
IUPAC Name: 7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-1H-quinolin-2-one | CAS Registry Number: 129722-25-4
Synonyms: CHEMBL161792, 7-(4-(4-(2,3-Dichlorophenyl)piperazin-1-yl)butoxy)quinolin-2(1H)-one, 7-[4-[4-(2,3-DICHLOROPHENYL)-1-PIPERAZINYL]BUTOXY]-2(1H)-QUINOLINONE, SureCN8423, UNII-2S514OZH3B, QUI013, CTK8C4455, MolPort-003-846-173, ANW-72044, AKOS015912272, AK-57245, KB-199812, L003824, I14-36622, 2(1H)-Quinolinone, 7-[4-[4-(2,3-dichlorophenyl)-1-piperazinyl]butoxy]-

Molecular Formula: C23H25Cl2N3O2Molecular Weight: 446.369500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CDONPRYEWWPREK-UHFFFAOYSA-N

• 3-methoxy-2-nitrobenzonitrile
IUPAC Name: 3-methoxy-2-nitrobenzonitrile | CAS Registry Number: 142596-50-7
Synonyms: 3-methoxy-2-nitro-benzonitrile, MolPort-002-462-107, CID10374991, EN001589

Molecular Formula: C8H6N2O3Molecular Weight: 178.144840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OXWWZQUPPXKYQB-UHFFFAOYSA-N

• 5-BENZO[D]IMIDAZOLECARBOXYLIC ACID 6-METHYL-,METHYL ESTER
IUPAC Name: methyl 6-methyl-1H-benzimidazole-5-carboxylate | CAS Registry Number: 10351-79-8
Synonyms: BEN050, AK-56734, KB-196748, Methyl 6-methyl-1H-benzo[d]imidazole-5-carboxylate, 5-benzimidazolecarboxylic acid,6-methyl-,methyl ester, 5-Benzimidazolecarboxylic acid, 6-methyl-, methyl ester

Molecular Formula: C10H10N2O2Molecular Weight: 190.198600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JOYVZOBWTHRPCY-UHFFFAOYSA-N

• 1-(4-METHYLPHENYL)-,DIMETHYL ESTER
IUPAC Name: dimethyl (1R,2S)-1-(4-methylphenyl)cyclopropane-1,2-dicarboxylate | CAS Registry Number: 345618-40-8
Synonyms: SureCN4451893, ZINC22010882, KB-00445, (1R,2S)-1-p-Tolyl-cyclopropane-1,2-dicarboxylic acid dimethyl ester

Molecular Formula: C14H16O4Molecular Weight: 248.274440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WOKDELUPEGODJT-RISCZKNCSA-N

• 1H-Pyrazolo[3,4-d]pyrimidine-3,4-diamine
IUPAC Name: 2H-pyrazolo[3,4-d]pyrimidine-3,4-diamine | CAS Registry Number: 640284-75-9
Synonyms: PYR015, CTK2F1897, AG-G-39474, KB-159260, 1H-Pyrazolo[3,4-d]pyrimidine-3,4-diamine (9CI);1H-Pyrazolo[3,4-d]pyrimidine-3,4-diamine

Molecular Formula: C5H6N6Molecular Weight: 150.141340 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: BDVYCPCRSZEUMD-UHFFFAOYSA-N

• 5-METHYL-4-OXOHEXANOIC ACID
IUPAC Name: 5-methyl-4-oxohexanoic acid | CAS Registry Number: 41654-04-0
Synonyms: NSC331769, CID38934

Molecular Formula: C7H12O3Molecular Weight: 144.168380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GQWLYLDUDAANSJ-UHFFFAOYSA-N

• 5A-ANDROSTAN-3-ONE
IUPAC Name: (5S,8S,9S,10S,13S,14S)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 1224-95-9
Synonyms: Androstan-3-one, 5alpha-Androstan-3-one, 5.alpha.-Androstan-3-one, 5alpha-Androstan-3-one (8CI), Androstan-3-one, (5.alpha.)-, NSC50893, CID102028, NSC 50893, Androstan-3-one, (5alpha)- (9CI), C02797

Molecular Formula: C19H30OMolecular Weight: 274.440900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VMNRNUNYBVFVQI-QYXZOKGRSA-N

• 3-Chloro Cinnamic Acid
IUPAC Name: (E)-3-(3-chlorophenyl)prop-2-enoic acid | CAS Registry Number: 1866-38-2
Synonyms: m-Chlorocinnamic acid, 3-CHLOROCINNAMIC ACID, (E)-m-Chlorocinnamic acid, ALBB-006018, NSC61876, EINECS 217-478-3, EINECS 238-466-4, CID735250, NSC 61876, NSC623439, SBB012383, (2E)-3-(3-chlorophenyl)acrylic acid, 14473-90-6, InChI=1/C9H7ClO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6H,(H,11,12)/b5-4

Molecular Formula: C9H7ClO2Molecular Weight: 182.603680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FFKGOJWPSXRALK-SNAWJCMRSA-N

• 3-CHLORO-N-SULPHAMYLPROPIONAMIDINE
IUPAC Name: 3-chloro-N'-sulfamoylpropanimidamide | CAS Registry Number: 106492-70-0
Synonyms: Propanimidamide, N-(aminosulfonyl)-3-chloro-, 3-chloro-N'-sulfamoylpropanimidamide, AC1MCL3L, ACMC-1C9GW, CTK0H3921, AG-C-26996, N-(AMINOSULFONYL)-3-CHLORO-PROPANIMIDAMIDE, 3-Chloro-N-sulfamoylpropionamidine;N-Sulfamoyl-3-chloropropionamidine;Propanimidamide, N'-(aminosulfonyl)-3-chloro-, (1E);(1Z)-2-amino-4-chloro-1-azabut-1-enesulfonamide;

Molecular Formula: C3H8ClN3O2SMolecular Weight: 185.632520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QZFCNUHDVLMXDA-UHFFFAOYSA-N

• 4'-(DIBROMOMETHYL)-[1,1'-BIPHENYL]-2-CARBONITRILE
IUPAC Name: 2-[4-(dibromomethyl)phenyl]benzonitrile | CAS Registry Number: 209911-63-7
Synonyms: SureCN4938738, BIP006, CTK4E5612, 2'-Cyano-4-(dibromomethyl)biphenyl, 4,4-Dibromomethyl-2'-cyanobiphenyl, 2-(4-Dibromomethylphenyl)benzonitrile, AKOS016011259, AG-E-54050, AK122198, KB-238945, 2'-Cyano-4-(dibromomethyl)-1,1'-biphenyl, 4'-(Dibromomethyl)[1,1'-biphenyl]-2-carbonitrile, [1,1'-Biphenyl]-2-carbonitrile, 4'-(dibromomethyl)-

Molecular Formula: C14H9Br2NMolecular Weight: 351.035960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JFOGXCVQPLGLLD-UHFFFAOYSA-N

• 2-Propenoic Acid, 3-[[4-(acetylamino)-3-Ethoxyphenyl]amino]-2-Cyano-, Ethyl Ester
IUPAC Name: ethyl 3-(4-acetamido-3-ethoxyanilino)-2-cyanoprop-2-enoate | CAS Registry Number: 848133-74-4
Synonyms: AGN-PC-005DTX, A840938, ethyl (E)-3-(4-acetamido-3-ethoxyanilino)-2-cyanoprop-2-enoate, ethyl 3-[(4-acetamido-3-ethoxy-phenyl)amino]-2-cyano-prop-2-enoate, 3-(4-acetamido-3-ethoxyanilino)-2-cyano-2-propenoic acid ethyl ester, 3-[[4-(ACETYLAMINO)-3-ETHOXYPHENYL]AMINO]-2-CYANO-2-PROPENOIC ACID ETHYL ESTER

Molecular Formula: C16H19N3O4Molecular Weight: 317.339760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: STFJATKWKPLWME-UHFFFAOYSA-N

• 2-(Boc-amino)-3-methylpyridine
IUPAC Name: tert-butyl N-(3-methylpyridin-2-yl)carbamate | CAS Registry Number: 138343-75-6
Synonyms: 2-(N-Boc-Amino)-3-methylpyridine, Carbamic acid, (3-methyl-2-pyridinyl)-, 1,1-dimethylethyl ester, AmbkkkkK141, SureCN68279, 2-BOC-Amino-3-picoline, Tert-butyl N-(3-methylpyridin-2-yl)carbamate, AGN-PC-00FB6P, 643920_ALDRICH, CAR006, CTK4C1210, MolPort-000-002-289, ANW-59611, ZINC12478442, AKOS004912563, AG-D-77589, MCULE-5085032225, RP26427, AK-45442, KB-21011, B67387

Molecular Formula: C11H16N2O2Molecular Weight: 208.256940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MJPLUXLNYQHWIU-UHFFFAOYSA-N

• 6-isopropylpyridazin-3-amine
IUPAC Name: 6-propan-2-ylpyridazin-3-amine | CAS Registry Number: 570416-37-4
Synonyms: MolPort-004-786-415, ZINC21982266, EN001264

Molecular Formula: C7H11N3Molecular Weight: 137.182340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QRQPUOPWIKVDOK-UHFFFAOYSA-N

• (4s)-1-Methyl-2,6-Dioxohexahydro-4-Pyrimidinecarboxylic Acid
IUPAC Name: (4S)-1-methyl-2,6-dioxo-1,3-diazinane-4-carboxylic acid | CAS Registry Number: 103365-69-1
Synonyms: (S)-1-METHYL-2,6-DIOXOHEXAHYDROPYRIMIDINE-4-CARBOXYLIc acid, 1-Methyl-L-4,5-dihydroorotic acid, (4S)-1-Methyl-2,6-Dioxohexahydro-4-Pyrimidinecarboxylic acid, (4S)-1-methyl-2,6-dioxo-1,3-diazinane-4-carboxylic acid, PubChem18233, 4-Pyrimidinecarboxylicacid, hexahydro-1-methyl-2,6-dioxo-, (4S)-, PYR140, CTK0H4981, MolPort-009-198-134, ANW-74968, AKOS006289959, AKOS015850776, AG-D-14064, AK-32702, BR-32702, KB-12934, AB1006722, AM20070686, FT-0649832, A800722

Molecular Formula: C6H8N2O4Molecular Weight: 172.138720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GWHDGNNXTNENIF-VKHMYHEASA-N

• (1R,1'R)-2,2'-(3,11-Dioxo-4,10-Dioxatridecamethylene)-Bis-(1,2,3,4-Tetrahydro-6,7-Dimethoxy-1-Veratrylisoquindline)-Dioxalate
IUPAC Name: 5-[3-[(1R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[(1R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate;oxalic acid | CAS Registry Number: 96687-52-4
Synonyms: CisAtracurium Oxalate, RL06086

Molecular Formula: C55H70N2O20Molecular Weight: 1079.145700 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 22

InChIKey: NGJVDNJEQWIMBU-DBGKOQSZSA-N

• 4-Oxocyclohexanecarboxylic Acid
IUPAC Name: 4-oxocyclohexane-1-carboxylic acid | CAS Registry Number: 874-61-3
Synonyms: 4-Oxo-chca, 4-Carboxycyclohexanone, 4-Oxocyclohexanecarboxylate, 4-Oxocyclohexanecarboxylic acid, 4-Ketocyclohexanecarboxylic acid, CHEBI:1921, 4-Oxo-cyclohexanecarboxylic acid, Cyclohexanecarboxylic acid, 4-oxo-, CID192730, ASN 13516979, C03767, T6397736

Molecular Formula: C7H10O3Molecular Weight: 142.152500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OWLXUYGCLDGHJJ-UHFFFAOYSA-N

• 3,5-diamino-1H-pyrazole-4-carbonitrile
IUPAC Name: 3,5-diamino-1H-pyrazole-4-carbonitrile | CAS Registry Number: 6844-58-2
Synonyms: MolPort-006-728-073, EN001271

Molecular Formula: C4H5N5Molecular Weight: 123.116000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UKASYLSHAZSEEV-UHFFFAOYSA-N

• 6-acetyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine
IUPAC Name: 1-(4-amino-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl)ethanone | CAS Registry Number: 1854-45-1
Synonyms: NSC107249, CID267681, EN000789

Molecular Formula: C8H10N4OMolecular Weight: 178.191200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: PWRQTCBFHZYALI-UHFFFAOYSA-N

• 1-PIPERAZINEACETIC ACID,4-(PYRIDIN-2-YL)-,ETHYL ESTER
IUPAC Name: ethyl 2-(4-pyridin-2-ylpiperazin-1-yl)acetate | CAS Registry Number: 86873-47-4
Synonyms: PIP007, MolPort-005-222-823, AKOS003969781, MCULE-3729884612, 1-Piperazineacetic acid, 4-(2-pyridinyl)-, ethyl ester

Molecular Formula: C13H19N3O2Molecular Weight: 249.308860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: NXVRTQIFASDCHY-UHFFFAOYSA-N

• 2,2'-DITHIOBIS THIAZOLE
IUPAC Name: 2-(1,3-thiazol-2-yldisulfanyl)-1,3-thiazole | CAS Registry Number: 20362-54-3
Synonyms: Thiazole, 2,2'-dithiobis-, 2-(1,3-thiazol-2-yldisulfanyl)-1,3-thiazole, NSC617651, AC1L7BMK, AC1Q7G2O, THI022, CTK1A1391, 2-thiazol-2-yldisulfanyl-thiazole, 2,2'-disulfanediylbis(1,3-thiazole), AG-E-49229, NSC-617651, 2,2'-Dithiobis(thiazole); 2-Thiazolyl disulfide; Bis(2-thiazolyl)disulfide;Di(2-thiazolyl) disulfide; NSC 617651

Molecular Formula: C6H4N2S4Molecular Weight: 232.369360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: MZIWZDMEFARRSI-UHFFFAOYSA-N

• 2-bromo-1-(1-methyl-1H-imidazol-2-yl)ethanone
IUPAC Name: 2-bromo-1-(1-methylimidazol-2-yl)ethanone | CAS Registry Number: 750556-81-1
Synonyms: MolPort-004-760-751, EN001275

Molecular Formula: C6H7BrN2OMolecular Weight: 203.036580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ONYYYUJTGNBSSD-UHFFFAOYSA-N

• 6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN-6-ONE,8-BROMO-11-ETHYL-5,11-DIHYDRO-5-METHYL-
IUPAC Name: 8-bromo-11-ethyl-5-methyldipyrido[2,3-d:2',3'-h][1,4]diazepin-6-one | CAS Registry Number: 162109-00-4
Synonyms: CHEMBL2115326, AC1LA2C2, SureCN5745003, DIP006, 8-Bromo-11-ethyl-5-methyldipyrido[3,2-b:2',3'-e][1,4]diazepin-6(5H)-one, 6H-Dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one, 8-bromo-11-ethyl-5,11-dihydro-5-methyl-

Molecular Formula: C14H13BrN4OMolecular Weight: 333.183220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BJEIQNJCEZCSQI-UHFFFAOYSA-N

• 1H-BENZO[D]IMIDAZOLE-4-CARBOXAMIDE,2,3-DIHYDRO-2-THIOXO-
IUPAC Name: 2-sulfanylidene-1,3-dihydrobenzimidazole-4-carboxamide | CAS Registry Number: 791591-51-0
Synonyms: BEN030, 1H-Benzimidazole-4-carboxamide, 2,3-dihydro-2-thioxo-

Molecular Formula: C8H7N3OSMolecular Weight: 193.225680 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: LUKMEALKPUFVQI-UHFFFAOYSA-N

• 19-Norandrost-5(10)-Ene-Dione
IUPAC Name: (8R,9S,13S,14S)-13-methyl-1,2,4,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione | CAS Registry Number: 3962-66-1
Synonyms: Oestr-5(10)-ene-3,17-dione, EINECS 223-564-1, LS-64836

Molecular Formula: C18H24O2Molecular Weight: 272.381960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RORYLAUXKSWMQL-CBZIJGRNSA-N

• 2,5-Dimethylpyrimidine
IUPAC Name: 2,5-dimethylpyrimidine | CAS Registry Number: 22868-76-4
Synonyms: Pyrimidine, 2,5-dimethyl-, AC1LBHIO, AC1Q4WNE, 2,5-Dimethylpyrimidine;, SureCN31255, Pyrimidine,2,5-dimethyl-, PYR129, CTK4F0355, MolPort-009-199-075, ANW-69271, AR-1D4488, AKOS016005911, AG-K-74166, RP18896, AK-34225, KB-225971

Molecular Formula: C6H8N2Molecular Weight: 108.141120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RHOOLJLEYYXKTK-UHFFFAOYSA-N

• 4-(2-aminoethyl)pyridin-2(1H)-one
IUPAC Name: 4-(2-aminoethyl)-1H-pyridin-2-one | CAS Registry Number: 746581-25-9
Synonyms: AmbitBI793, MolPort-002-344-317, MolPort-004-756-130, 4-(2-aminoethyl)-1H-pyridin-2-one, CID10351767, EN001683

Molecular Formula: C7H10N2OMolecular Weight: 138.167100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: USWVLANNWOEEMT-UHFFFAOYSA-N

• 2'-Methyl-1,1'-biphenyl-4-carbonitrile
IUPAC Name: 4-(2-methylphenyl)benzonitrile | CAS Registry Number: 189828-30-6
Synonyms: 4-(2-methylphenyl)benzonitrile, 2'-Methyl[1,1'-biphenyl]-4-carbonitrile, CBiol_000816, AC1LRCLG, ACMC-209et9, SureCN4877065, BIP019, CTK4E0233, MolPort-000-928-564, ANW-23467, ICCB4_000112, 4-(2-methylphenyl)benzenecarbonitrile, AKOS002683540, AG-E-38598, 2'-methyl-1,1'-biphenyl-4-carbonitrile, AK107703, KB-25164, 2'-Methyl-[1,1'-biphenyl]-4-carbonitrile, BB 0222999, [1,1'-Biphenyl]-4-carbonitrile,2'-methyl-

Molecular Formula: C14H11NMolecular Weight: 193.243840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NTJHRYFSZWZHPG-UHFFFAOYSA-N

• 5-(2-Ethoxyphenyl)-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]-7-pyrimidinone
IUPAC Name: 5-(2-ethoxyphenyl)-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one | CAS Registry Number: 139756-21-1
Synonyms: 5-(2-Ethoxyphenyl)-1-methyl-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one, 5-(2-Ethoxyphenyl)-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, SureCN1202, AC1LI7H5, MLS000704311, CHEMBL54079, 535524_ALDRICH, PYR115, CTK8B8749, CHEBI:180598, MolPort-003-847-155, HMS2511C22, ANW-61165, ZINC08855176, AKOS015911946, AC-16699, AK-59084, SMR000230865, UK 088800, FT-0668119

Molecular Formula: C17H20N4O2Molecular Weight: 312.366300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MXQUEDUMKWBYHI-UHFFFAOYSA-N

• 3-[(2-Aminoethyl)amino]propanenitrile
IUPAC Name: 3-(2-aminoethylamino)propanenitrile | CAS Registry Number: 22584-31-2
Synonyms: 4,7-Diazaheptane-1-nitrile, 2-(2-(Cyanoethyl)aminoethylamine, MolPort-005-932-914, CID89762, EINECS 245-109-6, N-(2-Cyanoethyl)-1,2-ethanediamine, N-(2-Cyanoethyl)-1,2-ethylenediamine, 3-((2-Aminoethyl)amino)propiononitrile, Propanenitrile, 3-((2-aminoethyl)amino)-, Propanenitrile, 3-((2-aminoethyl)amino)-, homopolymer, Propionitrile, 3-((2-aminoethyl)amino)-, polymers, 25609-52-3

Molecular Formula: C5H11N3Molecular Weight: 113.160940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NSQSYCXRUVZPKI-UHFFFAOYSA-N

• 3-Bromomethyl-1,2-Benzisoxazole
IUPAC Name: 3-(bromomethyl)-1,2-benzoxazole | CAS Registry Number: 37924-85-9
Synonyms: 3-(Bromomethyl)-1,2-benzisoxazole, 3-(bromomethyl)-1,2-benzoxazole, AC1MRVC9, 3-Bromomethylbenzisoxazole, 3-bromomethyl benzisoxazole, SureCN692195, 3-bromoethylbenzo[o]isoxazole, 3-bromomethyl-benzo[d]isoxazole, Jsp006674, CTK4H9022, ACN-S001694, AC-178, ZINC02509747, 1,2-Benzisoxazole,3-(bromomethyl)-, AKOS015936127, AG-F-33478, AB1004765, KB-178449, FT-0663771, A-2489

Molecular Formula: C8H6BrNOMolecular Weight: 212.043340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MAIKTETULSZRED-UHFFFAOYSA-N

• 2,3-Diaminobenzamide
IUPAC Name: 2,3-diaminobenzamide | CAS Registry Number: 711007-44-2
Synonyms: 2,3-diaminobenzamide, 2,3-Diamino-benzamide, BENZAMIDE, 2,3-DIAMINO-, PubChem19664, 2,3-Diaminobenzamide;, SureCN998313, BEN058, CTK2H6966, MolPort-005-936-383, ACN-S001620, ANW-61735, ZINC21987655, AKOS006287860, AG-C-20708, AG-G-78277, LS11444, QC-8426, RP21497, AC-17850, AK-32166

Molecular Formula: C7H9N3OMolecular Weight: 151.165860 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: NAWJZCSEYBQUGY-UHFFFAOYSA-N

• 1,3,5-Tris(aminomethyl)-2,4,6-Triethylbenzene
IUPAC Name: [3,5-bis(azaniumylmethyl)-2,4,6-triethylphenyl]methylazanium | CAS Registry Number: 149525-65-5
Synonyms: ZINC04202545

Molecular Formula: C15H30N3+3Molecular Weight: 252.418800 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 0

InChIKey: DBOPPHIBSRVLLK-UHFFFAOYSA-Q

• 2-Methoxy-4,5-Pyrimidinediamine
IUPAC Name: 2-methoxypyrimidine-4,5-diamine | CAS Registry Number: 104900-51-8
Synonyms: 2-methoxypyrimidine-4,5-diamine, 2-METHOXY-4,5-PYRIMIDINEDIAMINE, 4,5-PYRIMIDINEDIAMINE, 2-METHOXY, SureCN3417147, PYR095, 4,5-pyrimidinediamine,2-methoxy, CTK8C0998, MolPort-004-758-403, 4,5-Pyrimidinediamine, 2-methoxy-, ANW-65682, AKOS006287576, AK-89413, EN001613, KB-188119, I14-39180

Molecular Formula: C5H8N4OMolecular Weight: 140.143220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: FTRUYMYJTRHPIJ-UHFFFAOYSA-N

• 2-Phenylquinazolin-4-ol
IUPAC Name: 2-phenyl-1H-quinazolin-4-one | CAS Registry Number: 1022-45-3
Synonyms: 2-phenylquinazolin-4-ol, Maybridge1_006625, 2-Phenyl-3H-quinazolin-4-one, TimTec1_001395, 2-Phenyl-4(3H)-quinazolinone, 4(1H)-Quinazolinone, 2-phenyl-, Oprea1_322129, MLS001182239, 2-phenylquinazolin-4(3H)-one, HMS560F03, CHEBI:311307, MolPort-000-660-329, MolPort-000-820-642, NSC400966, HMS1537P09, PHAR157543, CID279959, NSC131274, ZINC17917305, AC-20408

Molecular Formula: C14H10N2OMolecular Weight: 222.242000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VDULOAUXSMYUMG-UHFFFAOYSA-N


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