Vitas-M small molecule compound
11-(2-chloro-6-fluorophenyl)-3-(4-ethoxy-3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK075909
SMILES CCOc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1c(F)cccc1Cl
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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 C28H26ClFN2O3 MW 492.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClFN2O3/c1-3-35-24-12-11-16(15-25(24)34-2)17-13-22-27(23(33)14-17)28(26-18(29)7-6-8-19(26)30)32-21-10-5-4-9-20(21)31-22/h4-12,15,17,28,31-32H,3,13-14H2,1-2H3InChIKey
LAZJQOHRNIEPBE-UHFFFAOYSA-NSynonyms
524001-01-211(2chloro6fluorophenyl)3(4ethoxy3methoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
524001012
6(2chloro6fluorophenyl)9(4ethoxy3methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=C(C=CC=C5Cl)F)C(=O)C2)OC
CCOc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1c(F)cccc1Cl
InChI=1SC28H26ClFN2O3c133524121116(1525(24)342)17132227(23(33)1417)28(2618(29)76819(26)30)32211054920(21)3122h4121517283132H31314H212H3
MFCD03489223
STK075909
ZINC000008846794
ZINC000008846797
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