N'-[(1-ethyl-5-fluoro-1H-pyrazol-4-yl)methylidene]-1-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]-1H-pyrazole-3-carbohydrazide
Chemical Structure Depiction of
N'-[(1-ethyl-5-fluoro-1H-pyrazol-4-yl)methylidene]-1-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]-1H-pyrazole-3-carbohydrazide
N'-[(1-ethyl-5-fluoro-1H-pyrazol-4-yl)methylidene]-1-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]-1H-pyrazole-3-carbohydrazide
Compound characteristics
| Compound ID: | Y505-3545 |
| Compound Name: | N'-[(1-ethyl-5-fluoro-1H-pyrazol-4-yl)methylidene]-1-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]-1H-pyrazole-3-carbohydrazide |
| Molecular Weight: | 376.31 |
| Molecular Formula: | C13 H13 F N10 O3 |
| Smiles: | CCn1c(c(/C=N/NC(c2ccn(Cn3cnc(n3)[N+]([O-])=O)n2)=O)cn1)F |
| Stereo: | ACHIRAL |
| logP: | 0.3489 |
| logD: | 0.3448 |
| logSw: | -1.8707 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 122.763 |
| InChI Key: | LRGXMQOZVHCCQB-UHFFFAOYSA-N |