N-(4-bromo-3-methylphenyl)-5-(4-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-5-(4-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
N-(4-bromo-3-methylphenyl)-5-(4-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-0963 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-5-(4-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 390.21 |
| Molecular Formula: | C16 H13 Br F N5 O |
| Smiles: | Cc1cc(ccc1[Br])NC(c1c(Nc2ccc(cc2)F)[nH]nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9072 |
| logD: | 3.8413 |
| logSw: | -4.0107 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.555 |
| InChI Key: | UEDFSUKGYAVWFG-UHFFFAOYSA-N |