1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2,3-dimethoxyphenyl)methylidene]-4-(4-nitrophenyl)-1H-1,2,3-triazole-5-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2,3-dimethoxyphenyl)methylidene]-4-(4-nitrophenyl)-1H-1,2,3-triazole-5-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2,3-dimethoxyphenyl)methylidene]-4-(4-nitrophenyl)-1H-1,2,3-triazole-5-carbohydrazide
Compound characteristics
| Compound ID: | 2064-1374 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2,3-dimethoxyphenyl)methylidene]-4-(4-nitrophenyl)-1H-1,2,3-triazole-5-carbohydrazide |
| Molecular Weight: | 479.41 |
| Molecular Formula: | C20 H17 N9 O6 |
| Smiles: | COc1cccc(/C=N/NC(c2c(c3ccc(cc3)[N+]([O-])=O)nnn2c2c(N)non2)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 2.7248 |
| logD: | 2.7246 |
| logSw: | -3.2792 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 166.132 |
| InChI Key: | CPAIWZXDMIYZBO-UHFFFAOYSA-N |