4-{2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
Chemical Structure Depiction of
4-{2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
4-{2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
Compound characteristics
| Compound ID: | 1697-1592 |
| Compound Name: | 4-{2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid |
| Molecular Weight: | 429.39 |
| Molecular Formula: | C22 H15 N5 O5 |
| Smiles: | c1ccc(cc1)N1C(C(\C(c2ccc(cc2)[N+]([O-])=O)=N1)=N/Nc1ccc(cc1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3577 |
| logD: | 1.9625 |
| logSw: | -4.4305 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.907 |
| InChI Key: | SJELWFJXWSZHDS-UHFFFAOYSA-N |