Vitas-M small molecule compound
1-{3-(4-fluorophenyl)-1-hydroxy-11-[4-(pentyloxy)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}hexan-1-one
Catalog ID
STL149686
SMILES CCCCCC(=O)N1C(c2ccc(cc2)OCCCCC)C2=C(O)CC(CC2=Nc2c1cccc2)c1ccc(cc1)F
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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 C36H41FN2O3 MW 568.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H41FN2O3/c1-3-5-7-13-34(41)39-32-12-9-8-11-30(32)38-31-23-27(25-14-18-28(37)19-15-25)24-33(40)35(31)36(39)26-16-20-29(21-17-26)42-22-10-6-4-2/h8-9,11-12,14-21,27,36,40H,3-7,10,13,22-24H2,1-2H3InChIKey
FNMXUWJCDNINOF-UHFFFAOYSA-NSynonyms
1(3(4fluorophenyl)1hydroxy11(4(pentyloxy)phenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)hexan1one
MFCD04072764
ZINC000102927982
ZINC000102927989
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