8-benzoyl-11-(4-fluorophenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
8-benzoyl-11-(4-fluorophenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
8-benzoyl-11-(4-fluorophenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 3410-1732 |
| Compound Name: | 8-benzoyl-11-(4-fluorophenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C28 H25 F N2 O2 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)F)Nc3cc(ccc3N2)C(c2ccccc2)=O)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5678 |
| logD: | 5.0903 |
| logSw: | -5.579 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.215 |
| InChI Key: | QBBPTIJQORIYBA-SANMLTNESA-N |