methyl 7-(4-chlorophenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 7-(4-chlorophenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 7-(4-chlorophenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 4099-6617 |
| Compound Name: | methyl 7-(4-chlorophenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 481.98 |
| Molecular Formula: | C27 H28 Cl N O5 |
| Smiles: | CCOc1ccc(cc1OC)C1C(=C(C)NC2CC(CC(C1=2)=O)c1ccc(cc1)[Cl])C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1761 |
| logD: | 0.6958 |
| logSw: | -5.7887 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.664 |
| InChI Key: | HTOWWHLHOHKLTH-UHFFFAOYSA-N |