{4-[3-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[3-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}(phenyl)methanone
{4-[3-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | V004-3812 |
| Compound Name: | {4-[3-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}(phenyl)methanone |
| Molecular Weight: | 481.47 |
| Molecular Formula: | C26 H22 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc2C(=Nc3cc(ccc3Oc2c1)C(F)(F)F)N1CCN(CC1)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4604 |
| logD: | 3.9115 |
| logSw: | -4.4435 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.262 |
| InChI Key: | QODMLJRIGHBZEL-UHFFFAOYSA-N |