Vitas-M small molecule compound
11-(4-tert-butylphenyl)-7-chloro-3-(4-chlorophenyl)-10-hexanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK055947
SMILES CCCCCC(=O)N1c2ccc(cc2NC2=C(C1c1ccc(cc1)C(C)(C)C)C(=O)CC(C2)c1ccc(cc1)Cl)Cl
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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 C35H38Cl2N2O2 MW 589.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H38Cl2N2O2/c1-5-6-7-8-32(41)39-30-18-17-27(37)21-28(30)38-29-19-24(22-11-15-26(36)16-12-22)20-31(40)33(29)34(39)23-9-13-25(14-10-23)35(2,3)4/h9-18,21,24,34,38H,5-8,19-20H2,1-4H3InChIKey
YLSLKFWINHAIGF-UHFFFAOYSA-NSynonyms
11(4(tertbutyl)phenyl)7chloro3(4chlorophenyl)10hexanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(4tertbutylphenyl)7chloro3(4chlorophenyl)10hexanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4tertbutylphenyl)2chloro9(4chlorophenyl)5hexanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)Cl)NC4=C1C=CC(=C4)Cl)C5=CC=C(C=C5)C(C)(C)C
CCCCCC(=O)N1c2ccc(cc2NC2=C(C1c1ccc(cc1)C(C)(C)C)C(=O)CC(C2)c1ccc(cc1)Cl)Cl
InChI=1SC35H38Cl2N2O2c1567832(41)3930181727(37)2128(30)38291924(22111526(36)161222)2031(40)33(29)34(39)2391325(141023)35(23)4h91821243438H581920H214H3
MFCD03032944
STK055947
ZINC000098045016
ZINC000098045019
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.