4-[5-(2-chloro-8-methylquinolin-3-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[5-(2-chloro-8-methylquinolin-3-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
4-[5-(2-chloro-8-methylquinolin-3-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 5267-1717 |
| Compound Name: | 4-[5-(2-chloro-8-methylquinolin-3-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid |
| Molecular Weight: | 451.91 |
| Molecular Formula: | C24 H22 Cl N3 O4 |
| Smiles: | Cc1cccc2cc(C3CC(c4ccc(cc4)OC)=NN3C(CCC(O)=O)=O)c(nc12)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4215 |
| logD: | 1.4721 |
| logSw: | -4.4794 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.525 |
| InChI Key: | XWTTVGPAPPDRKG-FQEVSTJZSA-N |