5-amino-N-(5-chloro-2-methylphenyl)-1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(5-chloro-2-methylphenyl)-1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(5-chloro-2-methylphenyl)-1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C549-0170 |
| Compound Name: | 5-amino-N-(5-chloro-2-methylphenyl)-1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 359.79 |
| Molecular Formula: | C17 H15 Cl F N5 O |
| Smiles: | Cc1ccc(cc1NC(c1c(N)n(Cc2ccc(cc2)F)nn1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.7513 |
| logD: | 2.7508 |
| logSw: | -3.4267 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.59 |
| InChI Key: | KRKUSVAOJHMXEX-UHFFFAOYSA-N |