N-(3-chloro-4-methylphenyl)-1,5-diphenyl-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-1,5-diphenyl-1H-1,2,4-triazole-3-carboxamide
N-(3-chloro-4-methylphenyl)-1,5-diphenyl-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | D351-2108 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-1,5-diphenyl-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 388.85 |
| Molecular Formula: | C22 H17 Cl N4 O |
| Smiles: | Cc1ccc(cc1[Cl])NC(c1nc(c2ccccc2)n(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0065 |
| logD: | 6.0063 |
| logSw: | -6.1077 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.98 |
| InChI Key: | NWURUQHUWJOCIV-UHFFFAOYSA-N |