N-[4-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)phenyl]-2,5-bis(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[4-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)phenyl]-2,5-bis(trifluoromethyl)benzamide
N-[4-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)phenyl]-2,5-bis(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V021-1706 |
| Compound Name: | N-[4-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)phenyl]-2,5-bis(trifluoromethyl)benzamide |
| Molecular Weight: | 454.37 |
| Molecular Formula: | C22 H16 F6 N2 O2 |
| Smiles: | C1CCc2c(C1)c(c1ccc(cc1)NC(c1cc(ccc1C(F)(F)F)C(F)(F)F)=O)on2 |
| Stereo: | ACHIRAL |
| logP: | 6.2419 |
| logD: | 6.1208 |
| logSw: | -6.0935 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.519 |
| InChI Key: | POSDGUMLHISKLP-UHFFFAOYSA-N |