11-(2,5-difluorophenyl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(2,5-difluorophenyl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(2,5-difluorophenyl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
Compound ID: | 8014-3749 |
Compound Name: | 11-(2,5-difluorophenyl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
Molecular Weight: | 416.47 |
Molecular Formula: | C26 H22 F2 N2 O |
Smiles: | Cc1ccc(cc1)C1CC2=C(C(c3cc(ccc3F)F)Nc3ccccc3N2)C(C1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 6.1346 |
logD: | 6.1234 |
logSw: | -5.4501 |
Hydrogen bond acceptors count: | 2 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 36.477 |
InChI Key: | VAHFXAKKGRJRCZ-UHFFFAOYSA-N |