Vitas-M small molecule compound

3-(4-fluorophenyl)-11-(4-hydroxy-3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK407039
SMILES COc1cc(ccc1O)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)F

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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 C26H23FN2O3 MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FN2O3/c1-32-24-14-16(8-11-22(24)30)26-25-21(28-19-4-2-3-5-20(19)29-26)12-17(13-23(25)31)15-6-9-18(27)10-7-15/h2-11,14,17,26,28-30H,12-13H2,1H3
InChIKey
SWQKAUBNQMTHIB-UHFFFAOYSA-N
Synonyms
879045-35-9
3(4fluorophenyl)11(4hydroxy3methoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
879045359
9(4fluorophenyl)6(4hydroxy3methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)F)NC5=CC=CC=C5N2)O
InChI=1SC26H23FN2O3c132241416(81122(24)30)262521(2819423520(19)2926)1217(1323(25)31)156918(27)10715h2111417262830H1213H21H3
MFCD07402604
ZINC000013568558
ZINC000013568561

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Available files

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