N-(4-bromophenyl)-1-(4-fluorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-1-(4-fluorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
N-(4-bromophenyl)-1-(4-fluorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | D351-2573 |
| Compound Name: | N-(4-bromophenyl)-1-(4-fluorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 437.27 |
| Molecular Formula: | C21 H14 Br F N4 O |
| Smiles: | c1ccc(cc1)c1nc(C(Nc2ccc(cc2)[Br])=O)nn1c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.6009 |
| logD: | 5.6007 |
| logSw: | -5.8617 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.98 |
| InChI Key: | KMHAMYRALTZVCI-UHFFFAOYSA-N |