Vitas-M small molecule compound
11-(pyridin-4-yl)-3-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK051614
SMILES COc1c(OC)cc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccncc1
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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 C27H27N3O4 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O4/c1-32-23-14-18(15-24(33-2)27(23)34-3)17-12-21-25(22(31)13-17)26(16-8-10-28-11-9-16)30-20-7-5-4-6-19(20)29-21/h4-11,14-15,17,26,29-30H,12-13H2,1-3H3InChIKey
HRVLEZPULQITFY-UHFFFAOYSA-NSynonyms
11(pyridin4yl)3(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6pyridin4yl9(345trimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=NC=C5)C(=O)C2
COc1c(OC)cc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccncc1
InChI=1SC27H27N3O4c132231418(1524(332)27(23)343)17122125(22(31)1317)26(168102811916)3020754619(20)2921h411141517262930H1213H213H3
MFCD03489387
STK051614
ZINC000018106905
ZINC000018106913
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