Vitas-M small molecule compound
11-(6-chloro-4-oxo-4H-chromen-3-yl)-3-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK060578
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1coc2c(c1=O)cc(cc2)Cl
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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 C30H25ClN2O5 MW 528.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClN2O5/c1-36-26-9-7-16(13-27(26)37-2)17-11-23-28(24(34)12-17)29(33-22-6-4-3-5-21(22)32-23)20-15-38-25-10-8-18(31)14-19(25)30(20)35/h3-10,13-15,17,29,32-33H,11-12H2,1-2H3InChIKey
LWJVUWUMGLWPQZ-UHFFFAOYSA-NSynonyms
11(6chloro4oxo4Hchromen3yl)3(34dimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(3(34DIMETHOXYPHENYL)1OXO(234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN11YL))6CHLOROCHROMEN4ONE
6(6chloro4oxochromen3yl)9(34dimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=COC6=C(C5=O)C=C(C=C6)Cl)C(=O)C2)OC
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1coc2c(c1=O)cc(cc2)Cl
InChI=1SC30H25ClN2O5c136269716(1327(26)372)17112328(24(34)1217)29(3322643521(22)3223)2015382510818(31)1419(25)30(20)35h310131517293233H1112H212H3
MFCD02104508
STK060578
ZINC000000709957
ZINC000000709960
Check stock
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Check stock on Vitas-MAvailable files
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