Vitas-M small molecule compound

1-[1-hydroxy-3-phenyl-11-(3,4,5-trimethoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]hexan-1-one

Catalog ID
STL528523
SMILES CCCCCC(=O)N1C(c2cc(OC)c(c(c2)OC)OC)C2=C(O)CC(CC2=Nc2c1cccc2)c1ccccc1

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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 C34H38N2O5 MW 554.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H38N2O5/c1-5-6-8-17-31(38)36-27-16-12-11-15-25(27)35-26-18-23(22-13-9-7-10-14-22)19-28(37)32(26)33(36)24-20-29(39-2)34(41-4)30(21-24)40-3/h7,9-16,20-21,23,33,37H,5-6,8,17-19H2,1-4H3
InChIKey
JWFWXDJJHHLZGF-UHFFFAOYSA-N
Synonyms

1(1hydroxy3phenyl11(345trimethoxyphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)hexan1one
InChI=1SC34H38N2O5c15681731(38)36271612111525(27)35261823(221397101422)1928(37)32(26)33(36)242029(392)34(414)30(2124)403h79162021233337H5681719H214H3
MFCD03813524
ZINC000102984528
ZINC000102984537

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Available files

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