N'-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1H-pyrazole-5-carbohydrazide
Chemical Structure Depiction of
N'-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1H-pyrazole-5-carbohydrazide
N'-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1H-pyrazole-5-carbohydrazide
Compound characteristics
Compound ID: | 1990-3823 |
Compound Name: | N'-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-1H-pyrazole-5-carbohydrazide |
Molecular Weight: | 303.23 |
Molecular Formula: | C12 H9 N5 O5 |
Smiles: | C1Oc2cc(/C=N/NC(c3ccn[nH]3)=O)c(cc2O1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 1.5488 |
logD: | 1.5295 |
logSw: | -2.2911 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 109.352 |
InChI Key: | DHUIDJDCGJPBDQ-UHFFFAOYSA-N |