Vitas-M small molecule compound

ethyl 4-(4-benzylpiperazin-1-yl)-3-[(phenylcarbonyl)amino]benzoate

Catalog ID
STK397430
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)c1ccccc1)N1CCN(CC1)Cc1ccccc1

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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 C27H29N3O3 MW 443.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O3/c1-2-33-27(32)23-13-14-25(24(19-23)28-26(31)22-11-7-4-8-12-22)30-17-15-29(16-18-30)20-21-9-5-3-6-10-21/h3-14,19H,2,15-18,20H2,1H3,(H,28,31)
InChIKey
QGJXDFKWLBLWFI-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4
ethyl3benzamido4(4benzylpiperazin1yl)benzoate
ETHYL4(4BENZYLPIPERAZIN1YL)3((PHENYLCARBONYL)AMINO)BENZOATE
InChI=1SC27H29N3O3c123327(32)23131425(24(1923)2826(31)22117481222)30171529(161830)202195361021h31419H2151820H21H3(H2831)
MFCD07174745
ZINC000016687794
ZINC16687794

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Available files

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