Vitas-M small molecule compound

1-[3-(4-chlorophenyl)-1-hydroxy-11-(4-methylphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]hexan-1-one

Catalog ID
STK196699
SMILES CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)Cl)C1c1ccc(cc1)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 C32H33ClN2O2 MW 513.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33ClN2O2/c1-3-4-5-10-30(37)35-28-9-7-6-8-26(28)34-27-19-24(22-15-17-25(33)18-16-22)20-29(36)31(27)32(35)23-13-11-21(2)12-14-23/h6-9,11-18,24,32,36H,3-5,10,19-20H2,1-2H3
InChIKey
NLGXIHOHGWUPLO-UHFFFAOYSA-N
Synonyms

1(3(4chlorophenyl)1hydroxy11(4methylphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)hexan1one
MFCD03759972
ZINC000100429675
ZINC000100429685

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Available files

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