Vitas-M small molecule compound

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

Catalog ID
STK564305
SMILES CCC(=O)N1C(c2cccc(c2)O)C2=C(O)CC(CC2=Nc2c1cccc2)(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 C24H26N2O3 MW 390.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O3/c1-4-21(29)26-19-11-6-5-10-17(19)25-18-13-24(2,3)14-20(28)22(18)23(26)15-8-7-9-16(27)12-15/h5-12,23,27-28H,4,13-14H2,1-3H3
InChIKey
FBNCERRIEJOPAA-UHFFFAOYSA-N
Synonyms

1(1hydroxy11(3hydroxyphenyl)33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)propan1one
MFCD03809517
ZINC000102527104
ZINC000102527108

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Available files

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