1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(5-bromo-2-hydroxyphenyl)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'-[(5-bromo-2-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(5-bromo-2-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 1741-0847 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(5-bromo-2-hydroxyphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 514.25 |
| Molecular Formula: | C18 H12 Br N9 O5 |
| Smiles: | C(\c1cc(ccc1O)[Br])=N/NC(c1c(c2ccc(cc2)[N+]([O-])=O)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4 |
| logD: | 3.3967 |
| logSw: | -3.616 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 167.332 |
| InChI Key: | OHAWZQFPYKRSTN-UHFFFAOYSA-N |