N-(3-chloro-4-methylphenyl)-5-(3-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-5-(3-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
N-(3-chloro-4-methylphenyl)-5-(3-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-0828 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-5-(3-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 345.76 |
| Molecular Formula: | C16 H13 Cl F N5 O |
| Smiles: | Cc1ccc(cc1[Cl])NC(c1c(Nc2cccc(c2)F)[nH]nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2472 |
| logD: | 4.1813 |
| logSw: | -4.5036 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.555 |
| InChI Key: | AVUYTHGSKFWGSP-UHFFFAOYSA-N |