methyl 4-[(2,4-dimethylphenyl)methoxy]-2-{[(2-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2,4-dimethylphenyl)methoxy]-2-{[(2-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate
methyl 4-[(2,4-dimethylphenyl)methoxy]-2-{[(2-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate
Compound characteristics
| Compound ID: | G198-0326 |
| Compound Name: | methyl 4-[(2,4-dimethylphenyl)methoxy]-2-{[(2-methylphenyl)methyl]sulfanyl}quinoline-3-carboxylate |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C28 H27 N O3 S |
| Smiles: | Cc1ccc(COc2c(C(=O)OC)c(nc3ccccc23)SCc2ccccc2C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.89 |
| logD: | 7.89 |
| logSw: | -5.8677 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.004 |
| InChI Key: | WHECSPLZRDPSCB-UHFFFAOYSA-N |