methyl 2-(benzylsulfanyl)-4-[(2,4-dimethylphenyl)methoxy]quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-(benzylsulfanyl)-4-[(2,4-dimethylphenyl)methoxy]quinoline-3-carboxylate
methyl 2-(benzylsulfanyl)-4-[(2,4-dimethylphenyl)methoxy]quinoline-3-carboxylate
Compound characteristics
| Compound ID: | G198-0169 |
| Compound Name: | methyl 2-(benzylsulfanyl)-4-[(2,4-dimethylphenyl)methoxy]quinoline-3-carboxylate |
| Molecular Weight: | 443.56 |
| Molecular Formula: | C27 H25 N O3 S |
| Smiles: | Cc1ccc(COc2c(C(=O)OC)c(nc3ccccc23)SCc2ccccc2)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.8123 |
| logD: | 6.8123 |
| logSw: | -5.8361 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.004 |
| InChI Key: | WRLRGJWCJTYNNF-UHFFFAOYSA-N |