1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromophenyl)methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromophenyl)methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromophenyl)methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 8007-4447 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-bromophenyl)methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 498.25 |
| Molecular Formula: | C18 H12 Br N9 O4 |
| Smiles: | C(\c1cccc(c1)[Br])=N/NC(c1c(c2cccc(c2)[N+]([O-])=O)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6391 |
| logD: | 3.6365 |
| logSw: | -4.1479 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 150.784 |
| InChI Key: | TVJAHNFXLZONPS-UHFFFAOYSA-N |