methyl 2-{[(4-fluorophenyl)methyl]sulfanyl}-4-[(4-methylphenyl)methoxy]quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[(4-fluorophenyl)methyl]sulfanyl}-4-[(4-methylphenyl)methoxy]quinoline-3-carboxylate
methyl 2-{[(4-fluorophenyl)methyl]sulfanyl}-4-[(4-methylphenyl)methoxy]quinoline-3-carboxylate
Compound characteristics
| Compound ID: | G198-0435 |
| Compound Name: | methyl 2-{[(4-fluorophenyl)methyl]sulfanyl}-4-[(4-methylphenyl)methoxy]quinoline-3-carboxylate |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C26 H22 F N O3 S |
| Smiles: | Cc1ccc(COc2c(C(=O)OC)c(nc3ccccc23)SCc2ccc(cc2)F)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.3958 |
| logD: | 6.3958 |
| logSw: | -5.9714 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.004 |
| InChI Key: | AFSGBBBOFKZIBK-UHFFFAOYSA-N |