2-methoxyethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-methoxyethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-methoxyethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 5991-0687 |
| Compound Name: | 2-methoxyethyl 4-(2H-1,3-benzodioxol-5-yl)-7-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 535.59 |
| Molecular Formula: | C30 H33 N O8 |
| Smiles: | CCOc1ccc(cc1OC)C1CC2=C(C(C(=C(C)N2)C(=O)OCCOC)c2ccc3c(c2)OCO3)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8924 |
| logD: | -0.5879 |
| logSw: | -3.9884 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.996 |
| InChI Key: | KAQQNHCRMPBFSE-UHFFFAOYSA-N |