4-{4-[(4-methoxyphenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoic acid
Chemical Structure Depiction of
4-{4-[(4-methoxyphenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoic acid
4-{4-[(4-methoxyphenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoic acid
Compound characteristics
| Compound ID: | 4410-3712 |
| Compound Name: | 4-{4-[(4-methoxyphenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoic acid |
| Molecular Weight: | 336.35 |
| Molecular Formula: | C19 H16 N2 O4 |
| Smiles: | CC1/C(=C/c2ccc(cc2)OC)C(N(c2ccc(cc2)C(O)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4179 |
| logD: | 1.0227 |
| logSw: | -3.4487 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.539 |
| InChI Key: | LXMDKDZKQNEHOO-UHFFFAOYSA-N |