methyl 4-[(2,5-dimethylphenyl)methoxy]-2-{[(4-fluorophenyl)methyl]sulfanyl}quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2,5-dimethylphenyl)methoxy]-2-{[(4-fluorophenyl)methyl]sulfanyl}quinoline-3-carboxylate
methyl 4-[(2,5-dimethylphenyl)methoxy]-2-{[(4-fluorophenyl)methyl]sulfanyl}quinoline-3-carboxylate
Compound characteristics
Compound ID: | G198-0439 |
Compound Name: | methyl 4-[(2,5-dimethylphenyl)methoxy]-2-{[(4-fluorophenyl)methyl]sulfanyl}quinoline-3-carboxylate |
Molecular Weight: | 461.55 |
Molecular Formula: | C27 H24 F N O3 S |
Smiles: | Cc1ccc(C)c(COc2c(C(=O)OC)c(nc3ccccc23)SCc2ccc(cc2)F)c1 |
Stereo: | ACHIRAL |
logP: | 6.9884 |
logD: | 6.9884 |
logSw: | -5.8703 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 37.004 |
InChI Key: | PDRKJDHQOCZYSC-UHFFFAOYSA-N |