4-{3-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-1-yl}-4-oxobutanoic acid
Chemical Structure Depiction of
4-{3-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-1-yl}-4-oxobutanoic acid
4-{3-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-1-yl}-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 3339-2380 |
| Compound Name: | 4-{3-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-1-yl}-4-oxobutanoic acid |
| Molecular Weight: | 399.88 |
| Molecular Formula: | C21 H22 Cl N3 O3 |
| Smiles: | CN(C)c1ccc(cc1)C1CC(c2ccc(cc2)[Cl])=NN1C(CCC(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6655 |
| logD: | 0.7161 |
| logSw: | -4.3802 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.047 |
| InChI Key: | QEXXSDPLTRYSMZ-LJQANCHMSA-N |