methyl 4-[(2,4-dimethylphenyl)methoxy]-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2,4-dimethylphenyl)methoxy]-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinoline-3-carboxylate
methyl 4-[(2,4-dimethylphenyl)methoxy]-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinoline-3-carboxylate
Compound characteristics
Compound ID: | G198-0789 |
Compound Name: | methyl 4-[(2,4-dimethylphenyl)methoxy]-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinoline-3-carboxylate |
Molecular Weight: | 471.62 |
Molecular Formula: | C29 H29 N O3 S |
Smiles: | Cc1ccc(COc2c(C(=O)OC)c(nc3ccccc23)SCc2cc(C)ccc2C)c(C)c1 |
Stereo: | ACHIRAL |
logP: | 8.3174 |
logD: | 8.3174 |
logSw: | -5.9024 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 37.004 |
InChI Key: | SUBYUJVXNXCSJN-UHFFFAOYSA-N |