5-amino-N-[(4-methylphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-[(4-methylphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-[(4-methylphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | K236-0173 |
| Compound Name: | 5-amino-N-[(4-methylphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 391.35 |
| Molecular Formula: | C18 H16 F3 N5 O2 |
| Smiles: | Cc1ccc(CNC(c2c(N)n(c3ccc(cc3)OC(F)(F)F)nn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3802 |
| logD: | 3.3802 |
| logSw: | -3.6726 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.683 |
| InChI Key: | GMKNRPRWGDZUPD-UHFFFAOYSA-N |