11-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepine
Chemical Structure Depiction of
11-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepine
11-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepine
Compound characteristics
| Compound ID: | V005-5624 |
| Compound Name: | 11-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepine |
| Molecular Weight: | 531.55 |
| Molecular Formula: | C26 H24 F3 N3 O4 S |
| Salt: | not_available |
| Smiles: | COc1ccc2c(c1)C(=Nc1cc(ccc1O2)C(F)(F)F)N1CCCN(CC1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9261 |
| logD: | 2.6866 |
| logSw: | -4.708 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.655 |
| InChI Key: | RJQKJJISGDJDSU-UHFFFAOYSA-N |