4-[3-methyl-5-oxo-4-(3-phenylprop-2-en-1-ylidene)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Chemical Structure Depiction of
4-[3-methyl-5-oxo-4-(3-phenylprop-2-en-1-ylidene)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
4-[3-methyl-5-oxo-4-(3-phenylprop-2-en-1-ylidene)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Compound characteristics
| Compound ID: | 4410-3723 |
| Compound Name: | 4-[3-methyl-5-oxo-4-(3-phenylprop-2-en-1-ylidene)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid |
| Molecular Weight: | 332.36 |
| Molecular Formula: | C20 H16 N2 O3 |
| Smiles: | CC1/C(=C/C=C/c2ccccc2)C(N(c2ccc(cc2)C(O)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0906 |
| logD: | 1.6954 |
| logSw: | -4.2057 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.995 |
| InChI Key: | KGRQDYPSOXAJLZ-UHFFFAOYSA-N |