5-(3-chloroanilino)-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-(3-chloroanilino)-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
5-(3-chloroanilino)-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-0901 |
| Compound Name: | 5-(3-chloroanilino)-N-(2,6-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 341.8 |
| Molecular Formula: | C17 H16 Cl N5 O |
| Smiles: | Cc1cccc(C)c1NC(c1c(Nc2cccc(c2)[Cl])[nH]nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5045 |
| logD: | 3.4386 |
| logSw: | -3.7203 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.16 |
| InChI Key: | FPWDQORALSGPOQ-UHFFFAOYSA-N |