2-ethoxyethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-ethoxyethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-ethoxyethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 4323-7137 |
| Compound Name: | 2-ethoxyethyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C27 H31 N O6 S |
| Smiles: | CCOCCOC(C1C(C2=C(CC(CC2=O)c2cccs2)NC=1C)c1ccc(c(c1)OCC)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0545 |
| logD: | -0.2913 |
| logSw: | -3.685 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.452 |
| InChI Key: | WTSQUMRNGPNCGH-UHFFFAOYSA-N |