N-{[3-(trifluoromethyl)phenyl]methyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{[3-(trifluoromethyl)phenyl]methyl}-2H-1,3-benzodioxole-5-carboxamide
N-{[3-(trifluoromethyl)phenyl]methyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-4384 |
| Compound Name: | N-{[3-(trifluoromethyl)phenyl]methyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 323.27 |
| Molecular Formula: | C16 H12 F3 N O3 |
| Smiles: | C(c1cccc(c1)C(F)(F)F)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4079 |
| logD: | 3.4079 |
| logSw: | -3.6902 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.767 |
| InChI Key: | YBBSAVFXMDRCMJ-UHFFFAOYSA-N |