[4-(2-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl][4-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
[4-(2-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl][4-(trifluoromethyl)phenyl]methanone
[4-(2-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl][4-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V004-7694 |
| Compound Name: | [4-(2-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl][4-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 495.5 |
| Molecular Formula: | C27 H24 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc2c(c1)C(=Nc1ccccc1O2)N1CCCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9338 |
| logD: | 3.722 |
| logSw: | -4.6657 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.593 |
| InChI Key: | KNMDKNLRQIUBFE-UHFFFAOYSA-N |