[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl][4-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl][4-(trifluoromethyl)phenyl]methanone
[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl][4-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V003-3660 |
| Compound Name: | [4-(4-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: | COc1cccc2C(=Nc3ccccc3Oc12)N1CCCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6201 |
| logD: | 3.5235 |
| logSw: | -4.5216 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.364 |
| InChI Key: | CYAISXLVLNKUBZ-UHFFFAOYSA-N |