{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}[2-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}[2-(trifluoromethyl)phenyl]methanone
{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}[2-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V005-4874 |
| Compound Name: | {4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}[2-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 549.47 |
| Molecular Formula: | C27 H21 F6 N3 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc2c(c1)C(=Nc1cc(ccc1O2)C(F)(F)F)N1CCN(CC1)C(c1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2202 |
| logD: | 4.0348 |
| logSw: | -5.1641 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.262 |
| InChI Key: | WJAAISRNCOXDEO-UHFFFAOYSA-N |