1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromo-4-fluorophenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromo-4-fluorophenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromo-4-fluorophenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 8007-8162 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromo-4-fluorophenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 516.24 |
| Molecular Formula: | C18 H11 Br F N9 O4 |
| Smiles: | C(\c1ccc(c(c1)[Br])F)=N/NC(c1c(c2ccc(cc2)[N+]([O-])=O)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3266 |
| logD: | 3.3241 |
| logSw: | -3.815 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 150.784 |
| InChI Key: | RNXPMALXDIUZFA-UHFFFAOYSA-N |