Vitas-M small molecule compound

4-(1H-indol-3-ylcarbonyl)-N-{3-[(3-methoxybenzyl)amino]-3-oxopropyl}piperazine-1-carboxamide

Catalog ID
STK622159
SMILES COc1cccc(c1)CNC(=O)CCNC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

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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 C25H29N5O4 MW 463.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O4/c1-34-19-6-4-5-18(15-19)16-28-23(31)9-10-26-25(33)30-13-11-29(12-14-30)24(32)21-17-27-22-8-3-2-7-20(21)22/h2-8,15,17,27H,9-14,16H2,1H3,(H,26,33)(H,28,31)
InChIKey
QERMVBDMDDGCQH-UHFFFAOYSA-N
Synonyms
929827-42-9
4(1Hindol3ylcarbonyl)N(3((3methoxybenzyl)amino)3oxopropyl)piperazine1carboxamide
4(1Hindole3carbonyl)N(3((3methoxybenzyl)amino)3oxopropyl)piperazine1carboxamide
4(1Hindole3carbonyl)N(3((3methoxyphenyl)methylamino)3oxopropyl)piperazine1carboxamide
929827429
COC1=CC=CC(=C1)CNC(=O)CCNC(=O)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43
COc1cccc(c1)CNC(=O)CCNC(=O)N1CCN(CC1)C(=O)c1c(nH)c2c1cccc2
InChI=1SC25H29N5O4c1341964518(1519)162823(31)9102625(33)30131129(121430)24(32)21172722832720(21)22h28151727H91416H21H3(H2633)(H2831)
MFCD09848133
ZINC000008991684
ZINC08991684
ZINC8991684

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Available files

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