Vitas-M small molecule compound
11-(3-chloro-4-hydroxy-5-methoxyphenyl)-3-(2-chlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK099685
SMILES COc1cc(cc(c1O)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1Cl
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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 C26H22Cl2N2O3 MW 481.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22Cl2N2O3/c1-33-23-13-15(10-18(28)26(23)32)25-24-21(29-19-8-4-5-9-20(19)30-25)11-14(12-22(24)31)16-6-2-3-7-17(16)27/h2-10,13-14,25,29-30,32H,11-12H2,1H3InChIKey
ZPTAUJDATJAHKY-UHFFFAOYSA-NSynonyms
11(3chloro4hydroxy5methoxyphenyl)3(2chlorophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3chloro4hydroxy5methoxyphenyl)9(2chlorophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4Cl)NC5=CC=CC=C5N2)Cl)O
COc1cc(cc(c1O)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1Cl
InChI=1SC26H22Cl2N2O3c133231315(1018(28)26(23)32)252421(2919845920(19)3025)1114(1222(24)31)16623717(16)27h210131425293032H1112H21H3
MFCD03307904
STK099685
ZINC000000720486
ZINC000000720489
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