5-amino-N-(5-chloro-2-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(5-chloro-2-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(5-chloro-2-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C549-0209 |
| Compound Name: | 5-amino-N-(5-chloro-2-methoxyphenyl)-1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 375.79 |
| Molecular Formula: | C17 H15 Cl F N5 O2 |
| Smiles: | COc1ccc(cc1NC(c1c(N)n(Cc2ccc(cc2)F)nn1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.5471 |
| logD: | 2.538 |
| logSw: | -3.4317 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.22 |
| InChI Key: | BBWLJRYQVYKDJC-UHFFFAOYSA-N |