6-chloro-N-{[4-(methylsulfanyl)phenyl]methyl}-2-(pyridin-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
6-chloro-N-{[4-(methylsulfanyl)phenyl]methyl}-2-(pyridin-3-yl)quinoline-4-carboxamide
6-chloro-N-{[4-(methylsulfanyl)phenyl]methyl}-2-(pyridin-3-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | G547-0303 |
| Compound Name: | 6-chloro-N-{[4-(methylsulfanyl)phenyl]methyl}-2-(pyridin-3-yl)quinoline-4-carboxamide |
| Molecular Weight: | 419.93 |
| Molecular Formula: | C23 H18 Cl N3 O S |
| Smiles: | CSc1ccc(CNC(c2cc(c3cccnc3)nc3ccc(cc23)[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5836 |
| logD: | 5.579 |
| logSw: | -5.9637 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.229 |
| InChI Key: | ULDHIRYRHMVGQR-UHFFFAOYSA-N |