Vitas-M small molecule compound

1-[3-(4-tert-butylphenyl)-1-hydroxy-11-(3,4,5-trimethoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone

Catalog ID
STK070227
SMILES COc1c(OC)cc(cc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)C(C)(C)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 C34H38N2O5 MW 554.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H38N2O5/c1-20(37)36-27-11-9-8-10-25(27)35-26-16-22(21-12-14-24(15-13-21)34(2,3)4)17-28(38)31(26)32(36)23-18-29(39-5)33(41-7)30(19-23)40-6/h8-15,18-19,22,32,38H,16-17H2,1-7H3
InChIKey
VHMNAMFQQZFDIU-UHFFFAOYSA-N
Synonyms

1(3(4tertbutylphenyl)1hydroxy11(345trimethoxyphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)ethanone
COc1c(OC)cc(cc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)C(C)(C)C
MFCD03034154
STK070227
ZINC000101100448
ZINC000101100452

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Available files

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