2-(ethylsulfanyl)ethyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-(ethylsulfanyl)ethyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-(ethylsulfanyl)ethyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 5991-0567 |
| Compound Name: | 2-(ethylsulfanyl)ethyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 611.76 |
| Molecular Formula: | C33 H41 N O8 S |
| Smiles: | CCOc1ccc(cc1OC)C1CC2=C(C(C(=C(C)N2)C(=O)OCCSCC)c2cc(c(c(c2)OC)OC)OC)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1848 |
| logD: | 0.7045 |
| logSw: | -5.0738 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.516 |
| InChI Key: | WWRACAHLGJEBNK-UHFFFAOYSA-N |