Vitas-M small molecule compound
11-(3-fluorophenyl)-3-(3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403463
SMILES COc1cccc(c1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cccc(c1)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 C26H23FN2O2 MW 414.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FN2O2/c1-31-20-9-5-6-16(13-20)18-14-23-25(24(30)15-18)26(17-7-4-8-19(27)12-17)29-22-11-3-2-10-21(22)28-23/h2-13,18,26,28-29H,14-15H2,1H3InChIKey
HLKCZBBFELTCRP-UHFFFAOYSA-NSynonyms
11(3fluorophenyl)3(3methoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3fluorophenyl)9(3methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC=CC(=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=CC=C5)F)C(=O)C2
InChI=1SC26H23FN2O2c1312095616(1320)18142325(24(30)1518)26(1774819(27)1217)292211321021(22)2823h21318262829H1415H21H3
MFCD03489305
ZINC000001439886
ZINC000001439889
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