Vitas-M small molecule compound

ethyl 3-({2-[4-(3-chlorophenyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate

Catalog ID
STK548908
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1cccc(c1)Cl)C)cccc2

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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 C24H27ClN4O3 MW 454.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN4O3/c1-3-32-24(31)22-21(19-9-4-5-10-20(19)26-22)27-23(30)16(2)28-11-13-29(14-12-28)18-8-6-7-17(25)15-18/h4-10,15-16,26H,3,11-14H2,1-2H3,(H,27,30)
InChIKey
RFKFFRTUKKYGAC-UHFFFAOYSA-N
Synonyms
836646-34-5
836646345
CCOC(=O)c1(nH)c2c(c1NC(=O)C(N1CCN(CC1)c1cccc(c1)Cl)C)cccc2
CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)C(C)N3CCN(CC3)C4=CC(=CC=C4)Cl
ETHYL3(((2R)2(4(3CHLOROPHENYL)PIPERAZIN1YL)PROPANOYL)AMINO)1HINDOLE2CARBOXYLATE
ethyl3((2(4(3chlorophenyl)piperazin1yl)propanoyl)amino)1Hindole2carboxylate
ethyl3(2(4(3chlorophenyl)piperazin1yl)propanamido)1Hindole2carboxylate
ETHYL3(2(4(3CHLOROPHENYL)PIPERAZIN1YL)PROPANOYLAMINO)1HINDOLE2CARBOXYLATE
InChI=1SC24H27ClN4O3c133224(31)2221(199451020(19)2622)2723(30)16(2)28111329(141228)1886717(25)1518h410151626H31114H212H3(H2730)
MFCD03691700
ZINC000057063757
ZINC000057063758

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Available files

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