5-(2-chloroanilino)-N-[(4-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-(2-chloroanilino)-N-[(4-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-(2-chloroanilino)-N-[(4-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-0866 |
| Compound Name: | 5-(2-chloroanilino)-N-[(4-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 357.8 |
| Molecular Formula: | C17 H16 Cl N5 O2 |
| Smiles: | COc1ccc(CNC(c2c(Nc3ccccc3[Cl])[nH]nn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5955 |
| logD: | 2.4936 |
| logSw: | -3.2257 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.723 |
| InChI Key: | RUILVJNDYHICKU-UHFFFAOYSA-N |