N-(2-bromo-4-methylphenyl)-5-(3-fluoro-4-methylanilino)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(2-bromo-4-methylphenyl)-5-(3-fluoro-4-methylanilino)-1H-1,2,3-triazole-4-carboxamide
N-(2-bromo-4-methylphenyl)-5-(3-fluoro-4-methylanilino)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-1049 |
| Compound Name: | N-(2-bromo-4-methylphenyl)-5-(3-fluoro-4-methylanilino)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 404.24 |
| Molecular Formula: | C17 H15 Br F N5 O |
| Smiles: | Cc1ccc(c(c1)[Br])NC(c1c(Nc2ccc(C)c(c2)F)[nH]nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.333 |
| logD: | 4.2671 |
| logSw: | -4.2768 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.857 |
| InChI Key: | CFAOHSCXRLSROC-UHFFFAOYSA-N |