Vitas-M small molecule compound

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

Catalog ID
STK403433
SMILES COc1cc(Br)c(cc1OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1cc(OC)c(c(c1)OC)OC

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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 C30H31BrN2O6 MW 595.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31BrN2O6/c1-35-24-14-18(19(31)15-25(24)36-2)29-28-22(32-20-8-6-7-9-21(20)33-29)10-16(11-23(28)34)17-12-26(37-3)30(39-5)27(13-17)38-4/h6-9,12-16,29,32-33H,10-11H2,1-5H3
InChIKey
RBLNOGDDPSHGLU-UHFFFAOYSA-N
Synonyms

11(2bromo45dimethoxyphenyl)3(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(2bromo45dimethoxyphenyl)9(345trimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=C(C=C5Br)OC)OC)C(=O)C2
InChI=1SC30H31BrN2O6c135241418(19(31)1525(24)362)292822(3220867921(20)3329)1016(1123(28)34)171226(373)30(395)27(1317)384h691216293233H1011H215H3
MFCD03489267
ZINC000053360145
ZINC000053360150

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Available files

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