Vitas-M small molecule compound
11-(3-ethoxy-4-hydroxyphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK064157
SMILES CCOc1cc(ccc1O)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)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 C28H28N2O4 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4/c1-3-34-26-16-18(10-13-24(26)31)28-27-23(29-21-6-4-5-7-22(21)30-28)14-19(15-25(27)32)17-8-11-20(33-2)12-9-17/h4-13,16,19,28-31H,3,14-15H2,1-2H3InChIKey
JJPGTIZLYKLPGF-UHFFFAOYSA-NSynonyms
312622-64-311(3ethoxy4hydroxyphenyl)3(4methoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312622643
6(3ethoxy4hydroxyphenyl)9(4methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC5=CC=CC=C5N2)O
CCOc1cc(ccc1O)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)OC
InChI=1SC28H28N2O4c1334261618(101324(26)31)282723(2921645722(21)3028)1419(1525(27)32)1781120(332)12917h41316192831H31415H212H3
MFCD01825195
STK064157
ZINC000000685707
ZINC000000685710
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