1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(5-nitrothiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(5-nitrothiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(5-nitrothiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 2130-0053 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N'-[(5-nitrothiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 363.31 |
| Molecular Formula: | C11 H9 N9 O4 S |
| Smiles: | Cc1c(C(N/N=C/c2ccc([N+]([O-])=O)s2)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | 1.413 |
| logD: | 1.4117 |
| logSw: | -2.3779 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 153.396 |
| InChI Key: | HGOXYCBZACXRQE-UHFFFAOYSA-N |