Vitas-M small molecule compound
1-(11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)hexan-1-one
Catalog ID
STL050299
SMILES CCCCCC(=O)N1C(c2ccc(c(c2)OCC)OCc2ccc(cc2)Cl)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 C36H41ClN2O4 MW 601.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H41ClN2O4/c1-5-7-8-13-33(41)39-29-12-10-9-11-27(29)38-28-21-36(3,4)22-30(40)34(28)35(39)25-16-19-31(32(20-25)42-6-2)43-23-24-14-17-26(37)18-15-24/h9-12,14-20,35,40H,5-8,13,21-23H2,1-4H3InChIKey
IYINDPUQFBSGFX-UHFFFAOYSA-NSynonyms
1(11(4((4chlorobenzyl)oxy)3ethoxyphenyl)1hydroxy33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)hexan1one
MFCD05726636
ZINC000102887927
ZINC000102887931
Check stock
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