N-(3-chloro-4-fluorophenyl)-1-(3,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-1-(3,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
N-(3-chloro-4-fluorophenyl)-1-(3,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E141-0381 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-1-(3,5-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 358.8 |
| Molecular Formula: | C18 H16 Cl F N4 O |
| Smiles: | Cc1cc(C)cc(c1)n1c(C)c(C(Nc2ccc(c(c2)[Cl])F)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.5891 |
| logD: | 4.349 |
| logSw: | -4.7218 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.173 |
| InChI Key: | YBEDZEZDZQDCRY-UHFFFAOYSA-N |