3-{3-(4-methoxyphenyl)-4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]-1H-pyrazol-1-yl}propanoic acid
Chemical Structure Depiction of
3-{3-(4-methoxyphenyl)-4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]-1H-pyrazol-1-yl}propanoic acid
3-{3-(4-methoxyphenyl)-4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]-1H-pyrazol-1-yl}propanoic acid
Compound characteristics
| Compound ID: | 5237-0515 |
| Compound Name: | 3-{3-(4-methoxyphenyl)-4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]-1H-pyrazol-1-yl}propanoic acid |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C24 H22 N4 O4 |
| Smiles: | CC1/C(=C/c2cn(CCC(O)=O)nc2c2ccc(cc2)OC)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.199 |
| logD: | -0.6213 |
| logSw: | -2.4285 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.545 |
| InChI Key: | IPZPKBKRCFLRIN-UHFFFAOYSA-N |