2-(2H-1,3-benzodioxol-5-yl)-N-{[4-(trifluoromethyl)phenyl]methyl}quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-{[4-(trifluoromethyl)phenyl]methyl}quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-{[4-(trifluoromethyl)phenyl]methyl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | V012-0243 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-{[4-(trifluoromethyl)phenyl]methyl}quinoline-4-carboxamide |
| Molecular Weight: | 450.42 |
| Molecular Formula: | C25 H17 F3 N2 O3 |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)C(F)(F)F)NC(c1cc(c2ccc3c(c2)OCO3)nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1907 |
| logD: | 6.1898 |
| logSw: | -6.3103 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.826 |
| InChI Key: | NZBPLEHEOKWILP-UHFFFAOYSA-N |