methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-[(2-methylphenyl)methoxy]quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-[(2-methylphenyl)methoxy]quinoline-3-carboxylate
methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-[(2-methylphenyl)methoxy]quinoline-3-carboxylate
Compound characteristics
| Compound ID: | G198-0751 |
| Compound Name: | methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-[(2-methylphenyl)methoxy]quinoline-3-carboxylate |
| Molecular Weight: | 481.97 |
| Molecular Formula: | C26 H21 Cl F N O3 S |
| Smiles: | Cc1ccccc1COc1c(C(=O)OC)c(nc2ccccc12)SCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 7.701 |
| logD: | 7.701 |
| logSw: | -6.6405 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.004 |
| InChI Key: | ZQFAZOVXAGXWEL-UHFFFAOYSA-N |