3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[3-(trifluoromethoxy)phenyl]propanamide
Chemical Structure Depiction of
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[3-(trifluoromethoxy)phenyl]propanamide
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[3-(trifluoromethoxy)phenyl]propanamide
Compound characteristics
| Compound ID: | S629-0256 |
| Compound Name: | 3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[3-(trifluoromethoxy)phenyl]propanamide |
| Molecular Weight: | 448.44 |
| Molecular Formula: | C23 H23 F3 N2 O4 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(C2CC2)=O)c1)C(Nc1cccc(c1)OC(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6754 |
| logD: | 4.6753 |
| logSw: | -4.6994 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.169 |
| InChI Key: | KCPHYTVQDNOOBN-UHFFFAOYSA-N |