Vitas-M small molecule compound

3-(3,4-dimethoxyphenyl)-11-(2-fluorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK080993
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccccc1F

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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 C27H25FN2O3 MW 444.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25FN2O3/c1-32-24-12-11-16(15-25(24)33-2)17-13-22-26(23(31)14-17)27(18-7-3-4-8-19(18)28)30-21-10-6-5-9-20(21)29-22/h3-12,15,17,27,29-30H,13-14H2,1-2H3
InChIKey
KEJCZAYCFMYQRW-UHFFFAOYSA-N
Synonyms

3(34dimethoxyphenyl)11(2fluorophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(34DIMETHOXYPHENYL)11(2FLUOROPHENYL)234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
9(34dimethoxyphenyl)6(2fluorophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=CC=C5F)C(=O)C2)OC
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccccc1F
InChI=1SC27H25FN2O3c13224121116(1525(24)332)17132226(23(31)1417)27(18734819(18)28)30211065920(21)2922h3121517272930H1314H212H3
MFCD01874808
STK080993
ZINC000000812849
ZINC000000812853

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Available files

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