{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}(thiophen-2-yl)methanone
{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | V005-4837 |
| Compound Name: | {4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazin-1-yl}(thiophen-2-yl)methanone |
| Molecular Weight: | 487.5 |
| Molecular Formula: | C24 H20 F3 N3 O3 S |
| Salt: | not_available |
| Smiles: | COc1ccc2c(c1)C(=Nc1cc(ccc1O2)C(F)(F)F)N1CCN(CC1)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7509 |
| logD: | 3.5655 |
| logSw: | -4.5535 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.28 |
| InChI Key: | KQOHAPAHTYCAMX-UHFFFAOYSA-N |