2-(5-chlorothiophen-2-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
Chemical Structure Depiction of
2-(5-chlorothiophen-2-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
2-(5-chlorothiophen-2-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C228-0376 |
| Compound Name: | 2-(5-chlorothiophen-2-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide |
| Molecular Weight: | 424.97 |
| Molecular Formula: | C22 H17 Cl N2 O S2 |
| Smiles: | CSc1ccc(CNC(c2cc(c3ccc(s3)[Cl])nc3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.6092 |
| logD: | 6.6092 |
| logSw: | -6.2064 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.729 |
| InChI Key: | CAEZMPPJYAFSTB-UHFFFAOYSA-N |