N-[3-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-5-(trifluoromethyl)phenyl]pent-4-enamide
Chemical Structure Depiction of
N-[3-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-5-(trifluoromethyl)phenyl]pent-4-enamide
N-[3-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-5-(trifluoromethyl)phenyl]pent-4-enamide
Compound characteristics
| Compound ID: | V030-1184 |
| Compound Name: | N-[3-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-5-(trifluoromethyl)phenyl]pent-4-enamide |
| Molecular Weight: | 364.37 |
| Molecular Formula: | C19 H19 F3 N2 O2 |
| Salt: | not_available |
| Smiles: | C=CCCC(Nc1cc(cc(c1)C(F)(F)F)c1c2CCCCc2no1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6176 |
| logD: | 5.6176 |
| logSw: | -5.7046 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.577 |
| InChI Key: | VNYAOTQUJGXVNG-UHFFFAOYSA-N |