Vitas-M small molecule compound

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

Catalog ID
STK561915
SMILES CCCOc1ccc(cc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)CC)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 C28H34N2O4 MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O4/c1-6-14-34-23-13-12-18(15-24(23)33-5)27-26-20(16-28(3,4)17-22(26)31)29-19-10-8-9-11-21(19)30(27)25(32)7-2/h8-13,15,27,31H,6-7,14,16-17H2,1-5H3
InChIKey
VJBNEAFHGLMOHW-UHFFFAOYSA-N
Synonyms

1(1hydroxy11(3methoxy4propoxyphenyl)33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)propan1one
MFCD03805151
ZINC000102508136
ZINC000102508140

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Available files

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