1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2-chloro-5-nitrophenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2-chloro-5-nitrophenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2-chloro-5-nitrophenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 2130-0068 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2-chloro-5-nitrophenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 391.73 |
| Molecular Formula: | C13 H10 Cl N9 O4 |
| Smiles: | Cc1c(C(N/N=C/c2cc(ccc2[Cl])[N+]([O-])=O)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | 2.1196 |
| logD: | 2.0113 |
| logSw: | -3.1567 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 152.026 |
| InChI Key: | DDDYKGRKBOFXGZ-UHFFFAOYSA-N |