Vitas-M small molecule compound

methyl 5-chloro-3-({2-[4-(2-hydroxyethyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate

Catalog ID
STK543075
SMILES OCCN1CCN(CC1)C(C(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H25ClN4O4 MW 408.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25ClN4O4/c1-12(24-7-5-23(6-8-24)9-10-25)18(26)22-16-14-11-13(20)3-4-15(14)21-17(16)19(27)28-2/h3-4,11-12,21,25H,5-10H2,1-2H3,(H,22,26)
InChIKey
MPQVXHQLZIQMPD-UHFFFAOYSA-N
Synonyms
500272-16-2
500272162
CC(C(=O)NC1=C(NC2=C1C=C(C=C2)Cl)C(=O)OC)N3CCN(CC3)CCO
InChI=1SC19H25ClN4O4c112(247523(6824)91025)18(26)2216141113(20)3415(14)2117(16)19(27)282h3411122125H510H212H3(H2226)
METHYL5CHLORO3(((2R)2(4(2HYDROXYETHYL)PIPERAZIN1YL)PROPANOYL)AMINO)1HINDOLE2CARBOXYLATE
METHYL5CHLORO3(((2S)2(4(2HYDROXYETHYL)PIPERAZIN1YL)PROPANOYL)AMINO)1HINDOLE2CARBOXYLATE
methyl5chloro3((2(4(2hydroxyethyl)piperazin1yl)propanoyl)amino)1Hindole2carboxylate
methyl5chloro3(2(4(2hydroxyethyl)piperazin1yl)propanamido)1Hindole2carboxylate
METHYL5CHLORO3(2(4(2HYDROXYETHYL)PIPERAZIN1YL)PROPANOYLAMINO)1HINDOLE2CARBOXYLATE
MFCD03302828
OCCN1CCN(CC1)C(C(=O)Nc1c((nH)c2c1cc(Cl)cc2)C(=O)OC)C
ZINC000020129779
ZINC000020129781

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.