Vitas-M small molecule compound

1-[1-hydroxy-11-(4-methylphenyl)-3-(3,4,5-trimethoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one

Catalog ID
STL045529
SMILES CCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2cc(OC)c(c(c2)OC)OC)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 C32H34N2O5 MW 526.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N2O5/c1-6-29(36)34-25-10-8-7-9-23(25)33-24-15-21(22-17-27(37-3)32(39-5)28(18-22)38-4)16-26(35)30(24)31(34)20-13-11-19(2)12-14-20/h7-14,17-18,21,31,35H,6,15-16H2,1-5H3
InChIKey
LHGAGWVBJOGORO-UHFFFAOYSA-N
Synonyms

1(1hydroxy11(4methylphenyl)3(345trimethoxyphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)propan1one
MFCD03798425
ZINC000102794795
ZINC000102794801

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Available files

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