N'-[(2,5-dibromo-3,4-dihydroxyphenyl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-carbohydrazide
Chemical Structure Depiction of
N'-[(2,5-dibromo-3,4-dihydroxyphenyl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-carbohydrazide
N'-[(2,5-dibromo-3,4-dihydroxyphenyl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-carbohydrazide
Compound characteristics
| Compound ID: | 8005-6071 |
| Compound Name: | N'-[(2,5-dibromo-3,4-dihydroxyphenyl)methylidene]-1,5-diphenyl-1H-1,2,4-triazole-3-carbohydrazide |
| Molecular Weight: | 557.2 |
| Molecular Formula: | C22 H15 Br2 N5 O3 |
| Smiles: | C(\c1cc(c(c(c1[Br])O)O)[Br])=N/NC(c1nc(c2ccccc2)n(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7658 |
| logD: | 5.5203 |
| logSw: | -5.7058 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.163 |
| InChI Key: | MCACQZTUMZKWNX-UHFFFAOYSA-N |