N'-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-methyl-4-nitro-1H-pyrazole-3-carbohydrazide
Chemical Structure Depiction of
N'-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-methyl-4-nitro-1H-pyrazole-3-carbohydrazide
N'-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-methyl-4-nitro-1H-pyrazole-3-carbohydrazide
Compound characteristics
| Compound ID: | Y508-0756 |
| Compound Name: | N'-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-methyl-4-nitro-1H-pyrazole-3-carbohydrazide |
| Molecular Weight: | 317.26 |
| Molecular Formula: | C13 H11 N5 O5 |
| Smiles: | Cn1cc(c(C(N/N=C/c2ccc3c(c2)OCO3)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.254 |
| logD: | 1.1004 |
| logSw: | -2.2015 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.106 |
| InChI Key: | BJRCWOCTXWMQRY-UHFFFAOYSA-N |