3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-[4-(dimethylamino)phenyl]-N-methyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-[4-(dimethylamino)phenyl]-N-methyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-[4-(dimethylamino)phenyl]-N-methyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Compound characteristics
| Compound ID: | G856-0658 |
| Compound Name: | 3-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-[4-(dimethylamino)phenyl]-N-methyl-4,5-dihydro-1H-pyrazole-1-carbothioamide |
| Molecular Weight: | 516.06 |
| Molecular Formula: | C28 H26 Cl N5 O S |
| Smiles: | CNC(N1C(CC(C2=C(c3ccccc3)c3cc(ccc3NC2=O)[Cl])=N1)c1ccc(cc1)N(C)C)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8389 |
| logD: | 5.7975 |
| logSw: | -6.0381 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.52 |
| InChI Key: | XXNYZGFIBWKBJR-XMMPIXPASA-N |