5-(furan-2-yl)-1-(3-methylphenyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
5-(furan-2-yl)-1-(3-methylphenyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,4-triazole-3-carboxamide
5-(furan-2-yl)-1-(3-methylphenyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | V013-2104 |
| Compound Name: | 5-(furan-2-yl)-1-(3-methylphenyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 426.4 |
| Molecular Formula: | C22 H17 F3 N4 O2 |
| Smiles: | Cc1cccc(c1)n1c(c2ccco2)nc(C(NCc2cccc(c2)C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7573 |
| logD: | 4.7573 |
| logSw: | -4.6149 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.881 |
| InChI Key: | XFXCVDORSKQTIF-UHFFFAOYSA-N |