3-phenyl-11-{2-[(propan-2-yl)oxy]phenyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
3-phenyl-11-{2-[(propan-2-yl)oxy]phenyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
3-phenyl-11-{2-[(propan-2-yl)oxy]phenyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 3192-5285 |
| Compound Name: | 3-phenyl-11-{2-[(propan-2-yl)oxy]phenyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C28 H28 N2 O2 |
| Smiles: | CC(C)Oc1ccccc1C1C2=C(CC(CC2=O)c2ccccc2)Nc2ccccc2N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0773 |
| logD: | 6.061 |
| logSw: | -5.5812 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.366 |
| InChI Key: | TXGPEJRELXGEPD-UHFFFAOYSA-N |