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MedKoo Biosciences

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Contact: Dr. Chris Chen - CEO and President
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Address: Research Triangle Park, Durham, North Carolina, USA
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Profile: MedKoo Biosciences is a provider of drug molecules and drug agents. We offer many active pharmaceutical ingredients and drug intermediates. Our API drugs include adapalene, adefovir dipivoxil, bicalutamide, dimecrotic acid, eperisone hydrochloride, lafutidine, levetiracetam, olmesartan, lomefloxacin monohydrochloride, pidotimod, risperidone, roxatidine acetate and rizatriptan benzoate. Our drug intermediates include adapalene, bicalutamide, escitalopram, olmesartan, pioglitazone, sumatriptan, temozolomide, pazufloxacin, liranaftate and zolmitriptan. We provide services such as collaboration research and contract organic synthesis, which include early stage discovery needs, medicinal & process chemistry. We offer products and service from discovery and early medicinal chemistry to multiple kilogram scale synthesis. Our research services include medicinal chemistry research, custom organic synthesis, synthetic route optimization, synthetic process development, formulation development and bioanalytical services. Our molecular building blocks are used for chemical modification of a lead molecule so as to enhance the potency, to reduce the side-effects, to improve oral bioavailability, and to increase aqueous solubility.

1 to 50 of 120 Products/Chemicals (Click for related suppliers)  Page: [1] 2 3 >> Next 50 Results
• Abiraterone acetate
IUPAC Name: [(3S,10R,13S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate | CAS Registry Number: 154229-18-2
Synonyms: UNII-EM5OCB9YJ6, CB 7630, CB-7630, CID132970, LS-182008, 17-(3-Pyridyl)-5,16-androstadien-3beta-acetate, Androsta-5,16-dien-3-ol, 17-(3-pyridinyl)-, acetate (ester), (3beta)-

Molecular Formula: C26H33NO2Molecular Weight: 391.545720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UVIQSJCZCSLXRZ-HMMZIKKISA-N

• Active Pharmaceutical Substances
• Adapalene
IUPAC Name: 6-[3-(1-adamantyl)-4-methoxyphenyl]naphthalene-2-carboxylic acid | CAS Registry Number: 106685-40-9
Synonyms: ADAPALENE, Differin, Differin (TN), Adapalenum [INN-Latin], Adapaleno [INN-Spanish], Ambap2675, Adapalene [USAN:BAN:INN], Adapalene (JAN/USAN/INN), MLS000759463, CHEBI:31174, CD 271, CD271, C28H28O3, CD-271, DB00210, NCGC00164617-01, CPD000466349, SAM001246663, SMR000466349, LS-172017

Molecular Formula: C28H28O3Molecular Weight: 412.520120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LZCDAPDGXCYOEH-UHFFFAOYSA-N

• Adefovir Dipivoxil
IUPAC Name: [2-(6-aminopurin-9-yl)ethoxymethyl-(2,2-dimethylpropanoyloxymethoxy)phosphoryl]oxymethyl 2,2-dimethylpropanoate | CAS Registry Number: 142340-99-6
Synonyms: Hepsera, Preveon, Adefovir pivoxil, ADEFOVIR DIPIVOXIL, Adefovirdipivoxl, YouHeDing, adefovir depivoxil, Bis(pom)PMEA, Hepsera (TN), Piv2PMEA, ADEFOVIR, bis-POM PMEA, PMEA, Bis(POM)-PMEA, Ambap2538, Adefovir pivoxil (JAN), Adefovir dipivoxil (USAN), C20H32N5O8P, GS 840, GS-840

Molecular Formula: C20H32N5O8PMolecular Weight: 501.470541 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 13

InChIKey: WOZSCQDILHKSGG-UHFFFAOYSA-N

• AMD 3100 Octahydrochloride
IUPAC Name: 1-[[4-(1,5,8,12-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,5,8,12-tetrazacyclotetradecane | CAS Registry Number: 155148-31-5
Synonyms: Plerixafor, Mozobil, bicyclam JM-2987, AMD3100, Amd 3100, SDZ SID 791, SID791, UNII-S915P5499N, GNA & AMD-3100, HHA & AMD-3100, CHEBI:120346, AIDS025303, AIDS224013, AIDS224020, AIDS-025303, AIDS-224013, AIDS-224020, AMD-3100, CID65015, JM 3100

Molecular Formula: C28H54N8Molecular Weight: 502.781960 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 8

InChIKey: YIQPUIGJQJDJOS-UHFFFAOYSA-N

• Amifostine
IUPAC Name: 2-(3-aminopropylamino)ethylsulfanylphosphonic acid trihydrate | CAS Registry Number: 112901-68-5
Synonyms: amifostine, Ethyol, Amifostine hydrate, Anifostine trihydrate, Amifostine (USP), Amifostine trihydrate, ETHYOL (TN), Amifostine [USAN:INN:BAN], C5H15N2O3PS.3H2O, NSC 296961, LS-172202, D00226, Ethanethiol, 2-((3-aminopropyl)amino)-, dihydrogen phosphate (ester), trihydrate, S-(2-((3-Aminopropyl)amino)ethyl) dihydrogen phosphorothioate, trihydrate

Molecular Formula: C5H21N2O6PSMolecular Weight: 268.268801 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 8

InChIKey: TXQPXJKRNHJWAX-UHFFFAOYSA-N

• Amonafide
Synonyms: Nafidimide, Amonifide, Amonafidum, Amonafida, Quinamed, Xanafide, Benzisoquinolinedione, 5-Aminomitonafide, Amonafidum [Latin], Amonafida [Spanish], Amonafide [INN], BIDA, NCIMech_000383, NSC308847, MLS000757039, UNII-1Q8D39N37L, M-FA 142, M-FA-142, NSC-308847, CGX-571

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

InChIKey: UPALIKSFLSVKIS-UHFFFAOYSA-N

• Anticancer Drugs
• Bendamustine
IUPAC Name: 4-[5-[bis(2-chloroethyl)amino]-1-methylbenzimidazol-2-yl]butanoic acid | CAS Registry Number: 16506-27-7
Synonyms: bendamustin, Cytostasan, Bendamustine [INN], Bendamustinum [Latin], Bendamustina [Spanish], Bendamustine (INN), Zimet 3393, SDX-105, C16H21Cl2N3O2, IMET 3393, SDX 105, CID65628, NCGC00181170-01, LS-32675, DD6304600, LS-173588, D07501, 5-(Bis(2-chloroethyl)amino)-1-methyl-2-benzimidazolebutyric acid, 2-Benzimidazolebutyric acid, 5-(bis(2-chloroethyl)amino)-1-methyl-, 1H-Benzimidazole-2-butanoic acid, 5-(bis(2-chloroethyl)amino)-1-methyl-

Molecular Formula: C16H21Cl2N3O2Molecular Weight: 358.262840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YTKUWDBFDASYHO-UHFFFAOYSA-N

• Beraprost Sodium
IUPAC Name: 4-[2-hydroxy-1-[(E)-3-hydroxy-4-methyloct-1-en-6-ynyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoic acid | CAS Registry Number: 88475-69-8
Synonyms: beraprost, Beraprost [USAN:INN], Beraprostum [INN-Latin], TRK 100, TRK-100, MDL 201229, C24H30O5, ML 1229, CID5282428, LS-57736, (+-)-(1R,2R,3aS,8bS)-2,3,3a,8b-Tetrahydro-2-hydroxy-1-((E)-(3S,4RS)-3-hydroxy-4-methyl-1-octen-6-ynyl)-1H-cyclopenta(b)benzofuran-5-butyric acid, 1H-Cyclopenta(b)benzofuran-5-butanoic acid, 2,3,3a,8b-tetrahydro-2-hydroxy-1-(3-hydroxy-4-methyl-1-octen-6-ynyl)-, 2-Hydroxy-1-(3-hydroxy-4-methyl-1-octen-6-ynyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta(b)benzofuran-5-butanoic acid, 1H-Cyclopenta(b)benzofuran-5-butanoic acid, 2,3,3a,8b-tetrahydro-2-hydroxy-1-(3-hydroxy-4-methyl-1-octen-6-ynyl)-, monosodium salt, 4-(1,2,3a,8b-tetrahydro-2-hydroxy-1-(3-hydroxy-4-methyloct-6-yne-1-enyl)-5-cyclopenta(b)benzofuranyl)butyrate, 88430-50-6

Molecular Formula: C24H30O5Molecular Weight: 398.492000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: CTPOHARTNNSRSR-OUKQBFOZSA-N

• Bicalutamide
IUPAC Name: (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenyl)sulfonyl-2-hydroxy-2-methylpropanamide | CAS Registry Number: 90357-06-5
Synonyms: bicalutamide, Casodex, (R)-Bicalutamide, R-BICALUTAMIDE, Bicalutamide [USAN:BAN:INN], CHEBI:3090, STOCK6S-47735, 1z95, CID56069, DB01128, DB02932, ICI 176334, BRN 5364666, NCGC00167487-01, (2R)-N-[4-CYANO-3-(TRIFLUOROMETHYL)PHENYL]-3-[(4-FLUOROPHENYL)SULFONYL]-2-HYDROXY-2-METHYLPROPANAMIDE, (+-)-4'-Cyano-alpha,alpha,alpha-trifluoro-3-((p-fluorophenyl)sulfonyl)-2-methyl-m-lactotoluidide, (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenyl)sulfonyl-2-hydroxy-2-methylpropanamide, Propanamide, N-(4-cyano-3-(trifluoromethyl)phenyl)-3-((4-fluorophenyl)sulfonyl)-2-hydroxy-2-methyl-, (+-)-

Molecular Formula: C18H14F4N2O4SMolecular Weight: 430.373373 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: LKJPYSCBVHEWIU-KRWDZBQOSA-N

• Bulk Drug Intermediates
• Bulk Drugs
• Canertinib dihydrochloride
IUPAC Name: N-[4-(3-chloro-4-fluoroanilino)-7-(3-morpholin-4-ylpropoxy)quinazolin-6-yl]prop-2-enamide dihydrochloride | CAS Registry Number: 289499-45-2
Synonyms: Canertinib dihydrochloride [USAN], CI-1033, Canertinib dihydrochloride (USAN), CI1033, CI 1033, PD-183805, CID156413, PD 183805, PD-0183805, LS-185636, D03350, 2-Propenamide, N-(4-((3-chloro-4-fluorophenyl) amino)-7-(3-(4-morpholinyl) propoxy)-6-quinazolinyl)-, dihydrochloride, N-(4-(3-chloro-4-fluorophenyl)amino)-7-(3-morpholin-4-yl)propoxy)quinazolin-6-yl)prop-2-enamide dihydrochloride, 2-Propenamide, N-(4-((3-chloro-4-fluorophenyl)amino)-7-(3-(4-morpholinyl)propoxy)-6-quinazolinyl)-, dihydrochloride

Molecular Formula: C24H27Cl3FN5O3Molecular Weight: 558.860283 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: JZZFDCXSFTVOJY-UHFFFAOYSA-N

• Carmustine
IUPAC Name: 1,3-bis(2-chloroethyl)-1-nitrosourea | CAS Registry Number: 154-93-8
Synonyms: carmustine, Carmustin, Nitrumon, BCNU, Carmubris, Gliadel, Becenum, BiCNU, Bischlorethylnitrosurea, Bi CNU, Bischlorethylnitrosourea, FIVB, Prestwick_997, Bischloroethylnitrosourea, carmustine in ethanol, BiCNU (TN), Bischloroethyl nitrosourea, 1,3-Bis(2-chloroethyl)-1-nitrosourea, Carmustinum [INN-Latin], Spectrum_000265

Molecular Formula: C5H9Cl2N3O2Molecular Weight: 214.049860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DLGOEMSEDOSKAD-UHFFFAOYSA-N

• Cediranib
IUPAC Name: 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazoline | CAS Registry Number: 288383-20-0
Synonyms: Recentin, AZD2171, AZD-2171, AZD 2171, S1017_Selleck, Kinome_3318, Cediranib (USAN/INN), UNII-NQU9IPY4K9, CHEMBL491473, AZD2171, Recentin, Cediranib, 4-(4-Fluoro-2-methylindol-5-yloxy)-6-methoxy-7-[3-(pyrrolidin-1-yl)propoxy]quinazoline, AKOS005145767, NSC-732208, ZD-2171, M6294, D08881, 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxy-7-[3-(pyrrolidin-1-yl)propoxy]quinazoline, 790713-41-6, Quinazoline, 4-((4-fluoro-2-methyl-1H-indol-5-yl)oxy)-6-methoxy-7-(3-(1-pyrrolidinyl)propoxy)-, Cadiranib

Molecular Formula: C25H27FN4O3Molecular Weight: 450.505283 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: XXJWYDDUDKYVKI-UHFFFAOYSA-N

• Cevipabulin
IUPAC Name: 5-chloro-6-[2,6-difluoro-4-[3-(methylamino)propoxy]phenyl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine | CAS Registry Number: 849550-05-6
Synonyms: TTI-237, Cevipabulin [INN], UNII-P14M0DWS2J, TTI 237, LS-194089

Molecular Formula: C18H18ClF5N6OMolecular Weight: 464.820136 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 11

InChIKey: ZUZPCOQWSYNWLU-VIFPVBQESA-N

• Chloromethyl Pivalate
IUPAC Name: chloromethyl 2,2-dimethylpropanoate | CAS Registry Number: 18997-19-8
Synonyms: Chloromethyl pivalate, POM-Cl, Pivaloyloxymethyl chloride, 141186_ALDRICH, TPC-I029, CID87885, EINECS 242-735-1, ZINC02242620, Propanoic acid, 2,2-dimethyl-, chloromethyl ester, TL8001550

Molecular Formula: C6H11ClO2Molecular Weight: 150.603340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GGRHYQCXXYLUTL-UHFFFAOYSA-N

• Cloretazine
IUPAC Name: 1-[2-chloroethyl(methylsulfonyl)amino]-3-methyl-1-methylsulfonylurea | CAS Registry Number: 173424-77-6
Synonyms: Laromustine, Onrigin, Cloretazine [INN], VNP-40101M, VNP40101M, VNP 40101M, CHEBI:377853, 101M, NSC734246, ZINC01544545, CID3081349, LS-183701, C483604, 1,2-Bis(methylsulfonyl)-1-(2-chloroethyl)-2-(methylaminocarbonyl)hydrazine, Methanesulfonic acid, 1-(2-chloroethyl)-2-((methylamino)carbonyl)-2-(methylsulfonyl)hydrazide, 1,2-bis(methylsulfonyl)-1-(2-chloroethyl)-2-((2-methylamino)carbonyl)hydrazine, 1,2-bis(methylsulfonyl)-1-(2-chloroethyl)-2-[(methylamino) carbonyl]hydrazine, 1,2-Bis(methylsulfonyl)-1-(2-chloroethyl)-2-[(methylamino)carbonyl]hydrazine

Molecular Formula: C6H14ClN3O5S2Molecular Weight: 307.775460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: PVCULFYROUOVGJ-UHFFFAOYSA-N

• Combretastatin A4 disodium phosphate
IUPAC Name: disodium;[2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] phosphate | CAS Registry Number: 168555-66-6
Synonyms: Fosbretabulin disodium, CA4DP, Zybrestat, Fosbretabulin disodium (USAN), Fosbretabulin disodium [USAN], Combretastatin A-4 phosphate, CA4P, AC1OCF9S, SureCN321426, CA 4P, CA-4P, UNII-702RHR475O, CHEMBL289351, CHEBI:152812, ACT03122, BCP9000542, NSC-752293, Combretastatin A4 Phosphate Disodium Salt, D09346, disodium [2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] phosphate

Molecular Formula: C18H19Na2O8PMolecular Weight: 440.291961 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: VXNQMUVMEIGUJW-XNOMRPDFSA-L

• Denibulin
IUPAC Name: methyl N-[6-[4-[[(2S)-2-aminopropanoyl]amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate | CAS Registry Number: 284019-34-7
Synonyms: Denibulin [INN], S1461_Selleck, SureCN14704035, UNII-K7037M241U, MN 029

Molecular Formula: C18H19N5O3SMolecular Weight: 385.440160 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: GAOHLWCIAJNSEE-JTQLQIEISA-N

• Drug Chemical Intermediate
• Drug Intermediates
• Dutasteride
IUPAC Name: (1S,3aS,3bS,5aR,9aR,11aS)-N-[2,5-bis(trifluoromethyl)phenyl]-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide | CAS Registry Number: 164656-23-9
Synonyms: Avodart, Dutasteride [USAN], C27H30F6N2O2, GG 745, DB01126, GI 198745, LS-173584, (5alpha,17beta)-N-(2,5-Bis(trifluoromethyl)phenyl)-3-oxo-4-azaandrost-1-ene-17-carboxamide, alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-3-oxo-4-aza-5alpha-androst-1-ene-17beta-carboxy-2',5'-xylidide, (1S,3aS,3bS,5aR,9aR,11aS)-N-[2,5-bis(trifluoromethyl)phenyl]-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide, 1H-Indeno(5,4-f)quinoline-7-carboxamide, N-(2,5-bis(trifluoromethyl)phenyl)-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-4a,6a-dimethyl-2-oxo-, (4aR,4bS,6aS,7S,9aS,9bS,11aR)-

Molecular Formula: C27H30F6N2O2Molecular Weight: 528.529719 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: JWJOTENAMICLJG-VYZSUTEISA-N

• Efaproxiral
IUPAC Name: 2-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]-2-methylpropanoic acid | CAS Registry Number: 131179-95-8
Synonyms: Efaproxyn, 2-Dacmpp, Rsr 13, Efaproxiral (USAN/INN), Efaproxiral [USAN:INN], RSR13, RSR 56, RSR-13, RSR-56, UNII-J81E81G364, C20H23NO4, CHEBI:121393, CID122335, LS-172793, D03961, 2-(4-(((3,5-dimethylanilino)carbonyl)methyl)phenoxy)-2-methylpropionic acid, RQ3, 2-(4-((3,5-Dimethylphenyl)amino)-2-oxoethyl)phenoxy)-2-methylpropanic acid, 2-{4-[(3,5-Dimethyl-phenylcarbamoyl)-methyl]-phenoxy}-2-methyl-propionic acid, 2-{4-[(3,5-Dimethyl-phenylcarbamoyl)-methyl]-phenoxy}-2-methyl-propionic acid (RSR13)

Molecular Formula: C20H23NO4Molecular Weight: 341.400920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BNFRJXLZYUTIII-UHFFFAOYSA-N

• Elagolix
IUPAC Name: 4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid | CAS Registry Number: 834153-87-6
Synonyms: CID11250647, CID 11250647

Molecular Formula: C32H30F5N3O5Molecular Weight: 631.589716 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 11

InChIKey: HEAUOKZIVMZVQL-VWLOTQADSA-N

• Elesclomol
IUPAC Name: 1-N',3-N'-bis(benzenecarbonothioyl)-1-N',3-N'-dimethylpropanedihydrazide | CAS Registry Number: 488832-69-5
Synonyms: UNII-6UK191M53P, NSC174939, STA 4783, STA-4783, CID300471, NCI60_001429, N'1,N'3-dimethyl-N'1,N'3-bis(phenylcarbonothioyl)propanedihydrazide, Propanedioic acid, bis[2-methyl-2-(phenylthioxomethyl)hydrazide]

Molecular Formula: C19H20N4O2S2Molecular Weight: 400.517700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: BKJIXTWSNXCKJH-UHFFFAOYSA-N

• Elinafide
Synonyms: Elinafide [INN], UNII-HL580335SI, CHEBI:142304, CID444912, Lu 79553, CID 444912, N,N'-(Trimethylenebis(iminoethylene))dinaphthalimide, 2-(2-{3-[2-(1,3-Dioxo-1H,3H-benzo[de]isoquinolin-2-yl)-ethylamino]-propylamino}-ethyl)-benzo[de]isoquinoline-1,3-dione, 2-(2-{3-[2-(1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinolin-2-yl)ethylamino]propylamino}ethyl)-2,3-dihydro-1H-benzo[de]isoquinoline-1,3-dione, 2-(2-{3-[2-(1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinolin-2-yl)ethylamino]propylamino}ethyl)-2,3-dihydro-1H-benzo[de]isoquinoline-1,3-dione(LU 79553), 2-(2-{3-[2-(1,3-Dioxo-2,3-dihydro-1H-phenalen-2-yl)-ethylamino]-propylamino}-ethyl)-benzo[de]isoquinoline-1,3-dione (LU 79553)

Molecular Formula: C31H28N4O4Molecular Weight: 520.578420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: QUNOQBDEVTWCTA-UHFFFAOYSA-N

• Eltrombopag
IUPAC Name: 3-[(5E)-5-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]hydrazinylidene]-6-oxocyclohexa-1,3-dien-1-yl]benzoic acid | CAS Registry Number: 496775-61-2
Synonyms: Promacta, Revolade, UNII-S56D65XJ9G, Eltrombopag [INN], SB 497115, 3'-[2-[(2Z)-1-(3,4-Dimethylphenyl)-1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene]hydrazinyl]-2'-hydroxy-[1,1'-biphenyl]-3-carboxylic acid, SB-497115-GR, EN002876, SB497115, [1,1'-Biphenyl]-3-carboxylic acid, 3'-[(2Z)-[1-(3,4-dime, PubChem20546, thylphenyl)-1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene]hydrazino]-2'-hydroxy- (9CI), (1,1'-Biphenyl)-3-carboxylic acid, 3'-((2Z)-(1-(3,4-dimethylphenyl)-1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene)hydrazino)-2'-hydroxy-, (E)-3\'-(2-(1-(3,4-Dimethylphenyl)-3-methyl-5-oxo-1H-pyrazol-4(5H)-ylidene)hydrazinyl)-2\'-hydroxybiphenyl-3-carboxylic acid, S56D65XJ9G, BCPP000243, ABP000381, AKOS015920246, BCP9000641, DB06210

Molecular Formula: C25H22N4O4Molecular Weight: 442.466580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: TYEXNVNUZXJNBN-YYADALCUSA-N

• Enzastaurin
IUPAC Name: 3-(1-methylindol-3-yl)-4-[1-[1-(pyridin-2-ylmethyl)piperidin-4-yl]indol-3-yl]pyrrole-2,5-dione | CAS Registry Number: 170364-57-5
Synonyms: UNII-UC96G28EQF, CHEBI:183217, CID176167, LY317615, 1H-Pyrrole-2,5-dione, 3-(1-methyl-1H-indol-3-yl)-4-(1-(1-(2-pyridinylmethyl)-4-piperidinyl)-1H-indol-3-yl)-, 3-(1-Methyl-1H-indol-3-yl)-4-[1-(1-pyridin-2-ylmethyl-piperidin-4-yl)-1H-indol-3-yl]-pyrrole-2,5-dione, 3-(1-methyl-1H-indol-3-yl)-4-{1-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1H-indol-3-yl}-1H-pyrrole-2,5-dione

Molecular Formula: C32H29N5O2Molecular Weight: 515.604960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: AXRCEOKUDYDWLF-UHFFFAOYSA-N

• Escitalopram Oxalate
IUPAC Name: (1S)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile; oxalic acid | CAS Registry Number: 219861-08-2
Synonyms: Lexapro, Escitalopram oxalate, Cipralex, Seroplex, Esertia, Gaudium, Entact, Lexapro (TN), Escitalopram oxalate [USAN], Escitalopram oxalate (USAN), MLS001401408, SPECTRUM1505216, (+)-(S)-Citalopram oxalate, MLD-55, Lu 26-054-0, NCGC00095903-01, CPD000469191, Lu-26-054-0, SAM001246668, SMR000469191

Molecular Formula: C22H23FN2O5Molecular Weight: 414.426823 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: KTGRHKOEFSJQNS-BDQAORGHSA-N

• Ethyl 2,4-dimethyl-5-(ethoxycarbonyl)-3-pyrrolepropionate
IUPAC Name: ethyl 4-(3-ethoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate | CAS Registry Number: 54278-10-3
Synonyms: 288934_ALDRICH, NSC157290, CID291761, ZINC00056662, ST5319892

Molecular Formula: C14H21NO4Molecular Weight: 267.320840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: ZYNJVGCLOFPWFZ-UHFFFAOYSA-N

• Exatecan
Synonyms: Exatecan [INN], UNII-OC71PP0F89, Dx 8951, CID151115, LS-39381, 10H,13H-Benzo(de)pyrano(3',4':6,7)indolizino(1,2-b)quinoline-10,13-dione, 1-amino-9-ethyl-5-fluoro-1,2,3,9,12,15-hexahydro-9-hydroxy-4-methyl-, (1S,9S)-, 10H,13H-Benzo(de)pyrano(3',4':6,7)indolizino(1,2-b)quinoline-10,13-dione, 1-amino-9-ethyl-5-fluoro-1,2,3,9,12,15-hexahydro-9-hydroxy-4-methyl-, (1S-trans)-, (1S,9S)-1-Amino-9-ethyl-5-fluoro-1,2,3,9,12,15-hexahydro-9-hydroxy-4-methyl-10H,13H-benzo(de)pyrano(3',4':6,7)indolizino(1,2-b)quinoline-10,13-dione

Molecular Formula: C24H22FN3O4Molecular Weight: 435.447583 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: ZVYVPGLRVWUPMP-FYSMJZIKSA-N

• Ezatiostat hydrochloride
IUPAC Name: ethyl (2S)-2-amino-5-[[(2R)-3-benzylsulfanyl-1-[[(1R)-2-ethoxy-2-oxo-1-phenylethyl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoate hydrochloride | CAS Registry Number: 286942-97-0
Synonyms: Ezatiostat HCl, UNII-D59N834676, gamma-Glu-S-BzCys-PhGly diethyl ester

Molecular Formula: C27H36ClN3O6SMolecular Weight: 566.109240 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: XJDYQYNYISTAMO-GFDYFVENSA-N

• Forodesine
IUPAC Name: 7-[(2S,3S,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one | CAS Registry Number: 209799-67-7
Synonyms: Fodosine, Immucillin H, Immucillin-H, Fodosine (TN), 1b8o, 1g2o, 1nw4, 2ff1, 2ff2, Forodesine (USAN/INN), UNII-426X066ELK, CHEBI:43362, CHEBI:460237, BCX-1777, CID444499, D06596, 1,4-dideoxy-4-aza-1-(s)-(9-deazahypoxanthin-9-yl)-d-ribitol, 2-(Acetylamino)-3-methoxy-N-(phenylmethyl)-, (2R)-, 1-(9-deazahypoxanthin-9-yl)-1,4-dideoxy-1,4-iminoribitol, (1S)-1,4-dideoxy-4-imino-(9-deazahypoxanthin-9-yl)-D-ribitol

Molecular Formula: C11H14N4O4Molecular Weight: 266.253260 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 6

InChIKey: IWKXDMQDITUYRK-KUBHLMPHSA-N

• Gimatecan
Synonyms: Gimatecan [INN], UNII-7KKS9R192F, LBQ707, 7-t-Butoxyiminomethylcamptothecin, CPT 184, CPT-184, LBQ-707, CHEBI:282377, 7-tert-Butoxyiminomethylcamptothecin, ST1481, CID9577124, ST 1481, ST-1481, LS-184222, 1H-Pyrano(3',4':6,7)indolizino(1,2-b)quinoline-11-carboxaldehyde, 4-ethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-, 11-(O-(1,1-dimethylethyl)oxime), (C(E),4S)-, (4S)-11-((E)-((1,1-Dimethylethoxy)imino)methyl)-4-ethyl-4-hydroxy-1,12-dihydro-14H-pyrano(3 ,4 :6,7)indolizino(1,2-b)quinoline-3,14(4H)-dione, (4S)-11-((E)-((1,1-DImethylethoxy)imino)methyl)-4-ethyl-4-hydroxy-1,12-dihydro-14H-pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H)-dione, (4S)-11-((E)-((1,1-Dimethylethoxy)imino)methyl)-4-ethyl-4-hydroxy-1,12-dihydro-14H-pyrano(3,4:6,7)indolizino(1,2-b)quinoline-3,14(4H)-dione, (S)-4-Ethyl-4-hydroxy-3,13-dioxo-3,4,12,13-tetrahydro-1H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-11-carbaldehyde O-tert-butyl-oxime, 1H-Pyrano(3',4':6,7)indolizino(1,2-b)quinoline-11-carboxaldehyde, 4-ethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-, 11-(O-(1,1-dimethylethyl)oxime), (4S)-

Molecular Formula: C25H25N3O5Molecular Weight: 447.483100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: UIVFUQKYVFCEKJ-OPTOVBNMSA-N

• Glufosfamide
IUPAC Name: (2S,3R,4S,5S,6R)-2-bis(2-chloroethylamino)phosphoryloxy-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 132682-98-5
Synonyms: glc-IPM, Glucosylifostamide mustard, Glucosyl-ifosfamide mustard, UNII-1W5N8SZD9A, HSDB 7024, CID123628, LS-71462, D 19575, D-19575, beta-D-Glucopyranose, 1-(N,N'-bis(2-chloroethyl)phosphorodiamidate), beta-D-Glucopyranose 1-(N,N'-bis(2-chloroethyl)phosphorodiamidate

Molecular Formula: C10H21Cl2N2O7PMolecular Weight: 383.162701 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 9

InChIKey: PSVUJBVBCOISSP-SPFKKGSWSA-N

• Imexon
IUPAC Name: 4-amino-1,3-diazabicyclo[3.1.0]hex-3-en-2-one | CAS Registry Number: 59643-91-3
Synonyms: Amplimexon, Imexonum, Imexon [INN], Imexonum [INN-Latin], C4H5N3O, I1631_SIGMA, UNII-8F63U28T2V, EINECS 261-838-2, CHEBI:346628, NSC313425, AIDS000351, NSC 313425, AIDS-000351, CID68791, NSC714597, BM 06002, BM-06002, AOP-990001, NCGC00181304-01, NCI60_002705

Molecular Formula: C4H5N3OMolecular Weight: 111.102000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BIXBBIPTYBJTRY-UHFFFAOYSA-N

• Indisulam
IUPAC Name: 1-N-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonamide | CAS Registry Number: 165668-41-7
Synonyms: Indisulam (IND), bis-sulfonamide indisulam, Indisulam (USAN/INN), CHEBI:222043, CID216468, E7070, E 7070, ER-35744, LS-30041, E-7070, N-(3-chloro-7-indolyl)-1,4-benzenedisulphonamide, D04522, N-(3-Chloro-1H-indol-7-yl)-1,4-benzenedisulfonamide, C439829, N-(3-chloro-7-indolyl)-1,4-benzenedisulfonamide, 1,4-Benzenedisulfonamide, N-(3-chloro-1H-indol-7-yl)-, N-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonamide, N-(3-Chloro-1H-indol-7-yl)benzene-1,4disulfonamide, N1-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonamide, Benzene-1,4-disulfonic acid 1-amide 4-[(3-chloro-1H-indol-7-yl)-amide]

Molecular Formula: C14H12ClN3O4S2Molecular Weight: 385.845780 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: SETFNECMODOHTO-UHFFFAOYSA-N

• Isatoribine hydrate
IUPAC Name: 5-amino-3-[(2S,3S,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4H-[1,3]thiazolo[4,5-d]pyrimidine-2,7-dione hydrate | CAS Registry Number: 198832-38-1
Synonyms: Isatoribine, Isatoribine [USAN:BAN], 5-Amino-3-beta-D-ribofuranosylthiazolo(4,5-d)pyrimidine-2,7(3H,6H)-dione monohydrate, Thiazolo(4,5-d)pyrimidine-2,7(3H,4H)-dione, 5-amino-3-beta-D-ribofuranosyl-, monohydrate

Molecular Formula: C10H14N4O7SMolecular Weight: 334.305760 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 9

InChIKey: BZWQQOVSUSJJJO-CPNJAUPDSA-N

• Karenitecin
Synonyms: UNII-24R60NVC41, 7-Trimethylsilylethylcamptothecin, BNP 1350, CID148202, DB 172, NSC710270, NCI60_038797, 1H-Pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H,12H)-dione, 4-ethyl-4-hydroxy-11-(2-trimethylsilyl)ethyl)-, (4S)-

Molecular Formula: C25H28N2O4SiMolecular Weight: 448.586320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: POADTFBBIXOWFJ-VWLOTQADSA-N

• Lafutidine
IUPAC Name: 2-(furan-2-ylmethylsulfinyl)-N-[(Z)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]acetamide | CAS Registry Number: 118288-08-7
Synonyms: lafutidine, Protecadin, Stogar, Lafutidine [INN], Protecadin (TN), Lafutidine (JAN/INN), FRG-8813, CID5282136, LS-9648, TL8000499, D01131, N-(4-(4-Piperidinylmethyl)pyridyl-2-oxy)butenyl-2-(furfurylsulfinyl)acetamide, (+-)-2-(Furfurylsulfinyl)-N-(4-(4-(piperidinomethyl)-2-pyridyl)oxy-(Z)-2-butenyl)acetamide, (+-)-2-(Furfurylsulfinyl)-N-((Z)-4-((4-(piperidinomethyl)-2-pyridyl)oxy)-2-butenyl) acetamide, Acetamide, 2-((2-furanylmethyl)sulfinyl)-N-(4-((4-(1-piperidinylmethyl)-2-pyridinyl)oxy)-2-butenyl)-, (Z)-, 143375-16-0

Molecular Formula: C22H29N3O4SMolecular Weight: 431.548360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: KMZQAVXSMUKBPD-DJWKRKHSSA-N

• Lasofoxifene
IUPAC Name: (5R,6S)-6-phenyl-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5,6,7,8-tetrahydronaphthalen-2-ol | CAS Registry Number: 180916-16-9
Synonyms: Oporia, Lasofoxifene [INN], CHEBI:262444, UNII-337G83N988, CID216416, CP 336156, LS-192130, CP-336,156, (5R,6S)-6-phenyl-5-(4-(2-(pyrrolidin-1-yl)ethoxy)phenyl)-5,6,7,8-tetrahydronaphthalen-2-ol, (5R,6S)-6-Phenyl-5-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-5,6,7,8-tetrahydro-naphthalen-2-ol, 2-Naphthalenol, 5,6,7,8-tetrahydro-6-phenyl-5-(4-(2-(1-pyrrolidinyl)ethoxy)phenyl)-, (5R,6S)-, 2-Naphthalenol, 5,6,7,8-tetrahydro-6-phenyl-5-(4-(2-(1-pyrrolidinyl)ethoxy)phenyl)-, (5R-cis)-, C3D, cis-1R-(4'-pyrrolidinoethoxyphenyl)-2S-phenyl-6-hydroxy-1,2,3,4-tetrahydronaphthalene, tartrate salt

Molecular Formula: C28H31NO2Molecular Weight: 413.551240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GXESHMAMLJKROZ-IAPPQJPRSA-N

• Levetiracetam
IUPAC Name: (2S)-2-(2-oxopyrrolidin-1-yl)butanamide | CAS Registry Number: 102767-28-2
Synonyms: Keppra, Etiracetam, Torleva, Keppra XR, etiracetam, S-isomer, Levetiracetam [INN], Etiracetam levo-isomer, ucb L060, SIB-S1, Levetiracetamum [INN-Latin], MLS000759403, MLS001424069, UCB-L059, C8H14N2O2, UCB-L 059, CID5284583, CPD000466303, SAM001246539, SMR000466303, (2S)-2-(2-oxopyrrolidin-1-yl)butanamide

Molecular Formula: C8H14N2O2Molecular Weight: 170.208960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HPHUVLMMVZITSG-LURJTMIESA-N

• Liranaftate
IUPAC Name: O-(5,6,7,8-tetrahydronaphthalen-2-yl) N-(6-methoxypyridin-2-yl)-N-methylcarbamothioate | CAS Registry Number: 88678-31-3
Synonyms: Piritetrate, Zefnart, Piritetate, Liranaftate [INN], Zefnart (TN), Liranaftatum [INN-Latin], Liranaftato [INN-Spanish], Liranaftate (JAN/INN), CID3936, AIDS029680, M-732, AIDS-029680, NCGC00164601-01, LS-50830, TL8005749, D01550, O-(5,6,7,8,-Tetrahydro-2-naphthyl) 6-methoxy-N-methylthio-2-pyridinecarbamate, Carbamothioic acid, (6-methoxy-2-pyridinyl)methyl-, O-(5,6,7,8-tetrahydro-2-naphthalenyl) ester

Molecular Formula: C18H20N2O2SMolecular Weight: 328.428600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VPHPQNGOVQYUMG-UHFFFAOYSA-N

• Lomeguatrib
IUPAC Name: 6-[(4-bromothiophen-2-yl)methoxy]-7H-purin-2-amine | CAS Registry Number: 192441-08-0
Synonyms: PaTrin 2, Lomeguatrib [INN], UNII-S79265T71M, CHEBI:316928, 6-(4-Bromothenyloxy)-7H-purin-2-amine, CID3025944, LS-184193, 6-((4-bromo-2-thienyl)methoxy)purin-2-amine, 6-((4-Bromo-2-thienyl)methoxyl)purin-2-amine, C521206, 6-(4-Bromo-thiophen-2-ylmethoxy)-9H-purin-2-ylamine, 793035-44-6

Molecular Formula: C10H8BrN5OSMolecular Weight: 326.172420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: JUJPKFNFCWJBCX-UHFFFAOYSA-N

• Lonafarnib
Synonyms: Sarasar, Lonafarnib [USAN], 1o5m, Sch66336, Lonafarnib (USAN/INN), Sch 66336, Sch-66336, UNII-IOW153004F, CHEBI:184655, CID148195, NSC719467, LS-184039, D04768, ( )4-(2-(4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H-benzo(5,6)cyclohepta(1,2-b)pyridin-11-yl)-1-piperidinyl)-2-oxoethyl)-1-piperidinecarboxamide, 1-Piperidinecarboxamide, 4-(2-(4-((11R)-3,10-dibromo-8-chloro-6,11-dihydro-5H-benzo(5,6)cyclohepta(1,2-b)pyridin-11-yl)-1-piperidinyl)-2-oxoethyl)-, 4-(2-(4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H-benzo-(5,6)-cyclohepta(1,2-b)-pyridin-11(R)-yl)-1-piperidinyl)-2-oxo-ethyl)-1-piperidinecarboxamide, (+)-4-(2-(4-(11R)-3,10-Dibromo-8-chloro-6,11-dihydro-5H-benzo(5,6)cyclohepta(1,2-b)pyridin-11-yl)-piperidin-1-yl))-2-oxoethyl)-piperidine-1-carboxamide, (+)-4[2-[4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H-benzo[5,6] cyclohepta[1,2-b]-pyridin-11(R)-yl-1-piperidinyl]-2-oxo-ethyl]-1-piperidinecarboxamide, (Sch-66336)4-{2-[4-(3,10-Dibromo-8-chloro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-yl)-piperidin-1-yl]-2-oxo-ethyl}-piperidine-1-carboxylic acid amide, 1-Piperidinecarboxamide, 4-(2-(4-((11R-3,10-dibromo-8-chloro-6,11-dihydro-5H-benzo(5,6)cyclohepta(1,2-b)pyridin-11-yl)-1-piperidinyl)-2-oxoethyl)-

Molecular Formula: C27H31Br2ClN4O2Molecular Weight: 638.821640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DHMTURDWPRKSOA-RUZDIDTESA-N

• Lucanthone
IUPAC Name: 1-(2-diethylaminoethylamino)-4-methylthioxanthen-9-one | CAS Registry Number: 479-50-5
Synonyms: Lucanthon, LUCANTHONE, Lucanthonum, Lucantona, Tixantone, Miracil D, Lucanthonum [INN-Latin], Lucantona [INN-Spanish], Lucanthone [INN:BAN], Lucanthone monohydrochloride, LUCANTHONE HYDROCHLORIDE, NCIMech_000830, CCRIS 1106, C20H24N2OS, CHEBI:51052, EINECS 207-532-4, AIDS013879, AIDS-013879, CID10180, NSC14574

Molecular Formula: C20H24N2OSMolecular Weight: 340.482360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FBQPGGIHOFZRGH-UHFFFAOYSA-N

• N-[(1S)-1-[[[(4R,7S)-Hexahydro-7-methyl-3-oxo-1-(2-pyridinylsulfonyl)-1H-azepin-4-yl]amino]carbonyl]-3-methylbutyl]-2-benzofurancarboxamide
IUPAC Name: N-[(2S)-4-methyl-1-[[(4R,7S)-7-methyl-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]-1-oxopentan-2-yl]-1-benzofuran-2-carboxamide | CAS Registry Number: 362507-64-0
Synonyms: Azepan-3-one compound 13, SureCN6215260, CHEMBL202991, CTK4H6142, AG-F-26218, 2-Benzofurancarboxamide,N-[(1S)-1-[[[(4R,7S)-hexahydro-7-methyl-3-oxo-1-(2-pyridinylsulfonyl)-1H-azepin-4-yl]amino]carbonyl]-3-methylbutyl]-, N-[(1S)-1-[[[(4R,7S)-Hexahydro-7-methyl-3-oxo-1-(2-pyridinylsulfonyl)-1H-azepin-4-yl]amino]carbonyl]-3-methylbutyl]-2-benzofurancarboxamide;N-((S)-4-methyl-1-((4R,7S)-7-methyl-3-oxo-1-(pyridin-2-ylsulfonyl)azepan-4-ylamino)-1-oxopentan-2-yl)benzofuran-2-carboxamide;N-[(2S)-4-Methyl-1-{[(4R,7S)-7-methyl-3-oxo-1-(pyridin-2-ylsulfonyl)azepan-4-yl]amino}-1-oxopentan-2-yl]-1-benzofuran-2-carboxamide;

Molecular Formula: C27H32N4O6SMolecular Weight: 540.631180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: BWYBBMQLUKXECQ-TYPHKJRUSA-N

• N-[4-cyano-3-(trifluoromethyl)phenyl]-2- Methyl-2-oxiranecarboxamide
IUPAC Name: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-methyloxirane-2-carboxamide | CAS Registry Number: 90357-51-0
Synonyms: N-(4-cyano-3-(trifluoromethyl)phenyl)-2-methyloxirane-2-carboxamide, N-[4-Cyano-3-(trifluoromethyl)phenyl]methacrylamideepoxide, 4-Cyano-N-(2,3-epoxy-2-methylpropionyl)-3-trifluoromethylaniline, N-[4-cyano-3-(trifluoromethyl)phenyl]-2-methyl-2-oxiranecarboxamide, N-[4-cyano-3-(trifluoromethyl)phenyl]-2-methyloxirane-2-carboxamide, PubChem13753, CTK7C8181, MolPort-003-987-413, ANW-46088, SBB067010, AKOS015900542, AC-1069, AG-A-74560, BD23063, LS10139, AK-44139, TL8005815, AM20041370, A10788, I14-0484

Molecular Formula: C12H9F3N2O2Molecular Weight: 270.207270 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: UQUQTWDUTIAAAY-UHFFFAOYSA-N


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