Vitas-M small molecule compound

1-[1-hydroxy-11-(4-methoxyphenyl)-8-methyl-3-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-methylpropan-1-one

Catalog ID
STL038505
SMILES COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(C)C)cc(C)cc2)c1ccccc1

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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 C31H32N2O3 MW 480.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O3/c1-19(2)31(35)33-27-16-20(3)10-15-25(27)32-26-17-23(21-8-6-5-7-9-21)18-28(34)29(26)30(33)22-11-13-24(36-4)14-12-22/h5-16,19,23,30,34H,17-18H2,1-4H3
InChIKey
DWIBFBWNCRXXRI-UHFFFAOYSA-N
Synonyms

1(1hydroxy11(4methoxyphenyl)8methyl3phenyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)2methylpropan1one
MFCD04076873
ZINC000102861341
ZINC000102861352

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Available files

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