Vitas-M small molecule compound

2,2,2-trifluoro-1-{1-hydroxy-3,3-dimethyl-11-[4-(pentyloxy)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}ethanone

Catalog ID
STK541410
SMILES CCCCCOc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(F)(F)F)cccc2)(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 C28H31F3N2O3 MW 500.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31F3N2O3/c1-4-5-8-15-36-19-13-11-18(12-14-19)25-24-21(16-27(2,3)17-23(24)34)32-20-9-6-7-10-22(20)33(25)26(35)28(29,30)31/h6-7,9-14,25,34H,4-5,8,15-17H2,1-3H3
InChIKey
FJZQUGVOOLIBQS-UHFFFAOYSA-N
Synonyms

222trifluoro1(1hydroxy33dimethyl11(4(pentyloxy)phenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)ethanone
MFCD07197471
ZINC000102429954
ZINC000102429959

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Available files

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