dimethyl 4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
dimethyl 4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
dimethyl 4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | 8016-2113 |
| Compound Name: | dimethyl 4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
| Molecular Weight: | 483.54 |
| Molecular Formula: | C25 H25 N O7 S |
| Smiles: | CC1=C(C(C2=C(CC(C(C2=O)C(=O)OC)c2cccs2)N1)c1ccc(c(c1)OC)O)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9134 |
| logD: | -1.1749 |
| logSw: | -3.0976 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.093 |
| InChI Key: | QPMHNDBVAUWGJQ-UHFFFAOYSA-N |