1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 6011-0598 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 399.37 |
| Molecular Formula: | C16 H17 N9 O4 |
| Smiles: | CN(C)Cc1c(C(N/N=C/c2ccc3c(c2)OCO3)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | 0.7033 |
| logD: | 0.2428 |
| logSw: | -2.0977 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 139.158 |
| InChI Key: | YAIDZXLTBFZMRS-UHFFFAOYSA-N |