methyl 8-chloro-4-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxo-1,2-dihydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 8-chloro-4-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxo-1,2-dihydroquinoline-3-carboxylate
methyl 8-chloro-4-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxo-1,2-dihydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | F474-3648 |
| Compound Name: | methyl 8-chloro-4-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxo-1,2-dihydroquinoline-3-carboxylate |
| Molecular Weight: | 388.87 |
| Molecular Formula: | C19 H17 Cl N2 O3 S |
| Smiles: | COC(C1=C(c2cccc(c2NC1=O)[Cl])NCc1ccc(cc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3513 |
| logD: | 3.2936 |
| logSw: | -3.7364 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.471 |
| InChI Key: | ZYTWTTXVDRZSOW-UHFFFAOYSA-N |