N-[2-chloro-5-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3494 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 358.75 |
| Molecular Formula: | C16 H14 Cl F3 N2 O2 |
| Smiles: | C1CCc2c(C(Nc3cc(ccc3[Cl])C(F)(F)F)=O)noc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.755 |
| logD: | 4.4258 |
| logSw: | -4.9551 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.363 |
| InChI Key: | GOQXUFJFWRFSCJ-UHFFFAOYSA-N |