methyl 4-[(2,4-dimethylphenyl)methoxy]-2-(methylsulfanyl)quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2,4-dimethylphenyl)methoxy]-2-(methylsulfanyl)quinoline-3-carboxylate
methyl 4-[(2,4-dimethylphenyl)methoxy]-2-(methylsulfanyl)quinoline-3-carboxylate
Compound characteristics
| Compound ID: | G198-0009 |
| Compound Name: | methyl 4-[(2,4-dimethylphenyl)methoxy]-2-(methylsulfanyl)quinoline-3-carboxylate |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C21 H21 N O3 S |
| Smiles: | Cc1ccc(COc2c(C(=O)OC)c(nc3ccccc23)SC)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.6618 |
| logD: | 5.6618 |
| logSw: | -5.6702 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.275 |
| InChI Key: | RDIIHXPJXAKNBW-UHFFFAOYSA-N |