N-[4-(trifluoromethoxy)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-[4-(trifluoromethoxy)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
N-[4-(trifluoromethoxy)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3497 |
| Compound Name: | N-[4-(trifluoromethoxy)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 340.3 |
| Molecular Formula: | C16 H15 F3 N2 O3 |
| Smiles: | C1CCc2c(C(Nc3ccc(cc3)OC(F)(F)F)=O)noc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.5231 |
| logD: | 4.523 |
| logSw: | -4.3802 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.997 |
| InChI Key: | PQEQGYHNRPSIEI-UHFFFAOYSA-N |