Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-11-(4-oxo-4H-chromen-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK049101
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1coc2c(c1=O)cccc2
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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 C30H26N2O5 MW 494.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O5/c1-35-26-12-11-17(15-27(26)36-2)18-13-23-28(24(33)14-18)29(32-22-9-5-4-8-21(22)31-23)20-16-37-25-10-6-3-7-19(25)30(20)34/h3-12,15-16,18,29,31-32H,13-14H2,1-2H3InChIKey
BCVNRUWVBAVXIF-UHFFFAOYSA-NSynonyms
297159-02-5297159025
3(3(34DIMETHOXYPHENYL)1OXO234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN11YL)CHROMEN4ONE
3(34dimethoxyphenyl)11(4oxo4Hchromen3yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(34dimethoxyphenyl)6(4oxochromen3yl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=COC6=CC=CC=C6C5=O)C(=O)C2)OC
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1coc2c(c1=O)cccc2
InChI=1SC30H26N2O5c13526121117(1527(26)362)18132328(24(33)1418)29(3222954821(22)3123)201637251063719(25)30(20)34h312151618293132H1314H212H3
MFCD01994630
STK049101
ZINC000018106345
ZINC000018106359
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