methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-[(3-fluorophenyl)methoxy]quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-[(3-fluorophenyl)methoxy]quinoline-3-carboxylate
methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-[(3-fluorophenyl)methoxy]quinoline-3-carboxylate
Compound characteristics
| Compound ID: | G198-0757 |
| Compound Name: | methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-[(3-fluorophenyl)methoxy]quinoline-3-carboxylate |
| Molecular Weight: | 485.94 |
| Molecular Formula: | C25 H18 Cl F2 N O3 S |
| Smiles: | COC(c1c(c2ccccc2nc1SCc1ccc(cc1[Cl])F)OCc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2926 |
| logD: | 7.2926 |
| logSw: | -6.6066 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.004 |
| InChI Key: | GMZVDKGCJWFZHF-UHFFFAOYSA-N |