Vitas-M small molecule compound

2,2,2-trifluoro-1-[1-hydroxy-11-(4-methoxyphenyl)-3-(2-propoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone

Catalog ID
STL050125
SMILES CCCOc1ccccc1C1CC(=C2C(=Nc3ccccc3N(C2c2ccc(cc2)OC)C(=O)C(F)(F)F)C1)O

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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 C31H29F3N2O4 MW 550.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29F3N2O4/c1-3-16-40-27-11-7-4-8-22(27)20-17-24-28(26(37)18-20)29(19-12-14-21(39-2)15-13-19)36(30(38)31(32,33)34)25-10-6-5-9-23(25)35-24/h4-15,20,29,37H,3,16-18H2,1-2H3
InChIKey
YRDNFDDUCVDUSR-UHFFFAOYSA-N
Synonyms

222trifluoro1(1hydroxy11(4methoxyphenyl)3(2propoxyphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)ethanone
MFCD05735991
ZINC000102886323
ZINC000102886328

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Available files

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