5-(4-chloroanilino)-N-(4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-(4-chloroanilino)-N-(4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
5-(4-chloroanilino)-N-(4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-0154 |
| Compound Name: | 5-(4-chloroanilino)-N-(4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 327.77 |
| Molecular Formula: | C16 H14 Cl N5 O |
| Smiles: | Cc1ccc(cc1)NC(c1c(Nc2ccc(cc2)[Cl])[nH]nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7217 |
| logD: | 3.6558 |
| logSw: | -4.2524 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.555 |
| InChI Key: | AHKHRELBERVQOD-UHFFFAOYSA-N |