N-[(4-fluorophenyl)methyl]-2-{[3-(methylsulfanyl)phenyl]sulfanyl}quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-2-{[3-(methylsulfanyl)phenyl]sulfanyl}quinoline-4-carboxamide
N-[(4-fluorophenyl)methyl]-2-{[3-(methylsulfanyl)phenyl]sulfanyl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K786-9273 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-2-{[3-(methylsulfanyl)phenyl]sulfanyl}quinoline-4-carboxamide |
| Molecular Weight: | 434.55 |
| Molecular Formula: | C24 H19 F N2 O S2 |
| Smiles: | CSc1cccc(c1)Sc1cc(C(NCc2ccc(cc2)F)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.1845 |
| logD: | 6.1845 |
| logSw: | -5.7396 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.072 |
| InChI Key: | XIOAZEKTJDNITN-UHFFFAOYSA-N |