methyl 4-[4-(acetyloxy)-3-ethoxyphenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-[4-(acetyloxy)-3-ethoxyphenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 4-[4-(acetyloxy)-3-ethoxyphenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 2984-4756 |
| Compound Name: | methyl 4-[4-(acetyloxy)-3-ethoxyphenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 505.57 |
| Molecular Formula: | C29 H31 N O7 |
| Smiles: | CCOc1cc(ccc1OC(C)=O)C1C(=C(C)NC2CC(CC(C1=2)=O)c1ccc(cc1)OC)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2772 |
| logD: | -0.2031 |
| logSw: | -4.4382 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.415 |
| InChI Key: | CXMBPRYNFCJEEL-UHFFFAOYSA-N |