4-[5-(2-chloro-6-ethoxyquinolin-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[5-(2-chloro-6-ethoxyquinolin-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
4-[5-(2-chloro-6-ethoxyquinolin-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Compound characteristics
Compound ID: | 5959-0172 |
Compound Name: | 4-[5-(2-chloro-6-ethoxyquinolin-3-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid |
Molecular Weight: | 451.91 |
Molecular Formula: | C24 H22 Cl N3 O4 |
Smiles: | CCOc1ccc2c(c1)cc(C1CC(c3ccccc3)=NN1C(CCC(O)=O)=O)c(n2)[Cl] |
Stereo: | RACEMIC MIXTURE |
logP: | 4.3264 |
logD: | 1.377 |
logSw: | -4.3649 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.334 |
InChI Key: | UHHWCEKYLGLFJV-NRFANRHFSA-N |