Vitas-M small molecule compound

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

Catalog ID
STK025606
SMILES COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)Cl

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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 C28H25ClN2O3 MW 472.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClN2O3/c1-17(32)31-25-6-4-3-5-23(25)30-24-15-20(18-7-11-21(29)12-8-18)16-26(33)27(24)28(31)19-9-13-22(34-2)14-10-19/h3-14,20,28,33H,15-16H2,1-2H3
InChIKey
MKPHVTAQTURYAD-UHFFFAOYSA-N
Synonyms

1(3(4chlorophenyl)1hydroxy11(4methoxyphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)ethanone
1(3(4chlorophenyl)1hydroxy11(4methoxyphenyl)34dihydro2Hdibenzo(be)(14)diazepin10(11H)yl)ethanone
COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)Cl
MFCD03194769
STK025606
ZINC000100426619
ZINC000100426627

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Available files

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