4-[5-(4-bromophenyl)-3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[5-(4-bromophenyl)-3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
4-[5-(4-bromophenyl)-3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 3330-1225 |
| Compound Name: | 4-[5-(4-bromophenyl)-3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid |
| Molecular Weight: | 578.85 |
| Molecular Formula: | C28 H21 Br Cl N3 O4 |
| Smiles: | C(CC(N1C(CC(C2=C(c3ccccc3)c3cc(ccc3NC2=O)[Cl])=N1)c1ccc(cc1)[Br])=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5506 |
| logD: | 2.6012 |
| logSw: | -5.7484 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.849 |
| InChI Key: | XMGDSIFIWYIZOF-QHCPKHFHSA-N |