Vitas-M small molecule compound
11-{4-[(2-fluorobenzyl)oxy]phenyl}-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK778969
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1ccc(cc1)OCc1ccccc1F
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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 C28H27FN2O2 MW 442.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27FN2O2/c1-28(2)15-24-26(25(32)16-28)27(31-23-10-6-5-9-22(23)30-24)18-11-13-20(14-12-18)33-17-19-7-3-4-8-21(19)29/h3-14,27,30-31H,15-17H2,1-2H3InChIKey
AZXBZCYPCIUTBU-UHFFFAOYSA-NSynonyms
11(4((2fluorobenzyl)oxy)phenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4((2fluorophenyl)methoxy)phenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CC=C(C=C4)OCC5=CC=CC=C5F)C(=O)C1)C
InChI=1SC28H27FN2O2c128(2)152426(25(32)1628)27(31231065922(23)3024)18111320(141218)331719734821(19)29h314273031H1517H212H3
MFCD05857645
ZINC000012402405
ZINC000012402406
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