methyl 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-[(5-formyl-2-methoxyphenyl)methoxy]quinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-[(5-formyl-2-methoxyphenyl)methoxy]quinoline-3-carboxylate
methyl 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-[(5-formyl-2-methoxyphenyl)methoxy]quinoline-3-carboxylate
Compound characteristics
| Compound ID: | C201-0362 |
| Compound Name: | methyl 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-[(5-formyl-2-methoxyphenyl)methoxy]quinoline-3-carboxylate |
| Molecular Weight: | 501.6 |
| Molecular Formula: | C29 H27 N O5 S |
| Smiles: | Cc1ccc(C)c(CSc2c(C(=O)OC)c(c3ccccc3n2)OCc2cc(C=O)ccc2OC)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.8444 |
| logD: | 6.8444 |
| logSw: | -5.8828 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.793 |
| InChI Key: | GEWIFCXKCDDLFW-UHFFFAOYSA-N |