6-methyl 3-(propan-2-yl) 4-(3-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
6-methyl 3-(propan-2-yl) 4-(3-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
6-methyl 3-(propan-2-yl) 4-(3-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | C142-0094 |
| Compound Name: | 6-methyl 3-(propan-2-yl) 4-(3-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
| Molecular Weight: | 457.52 |
| Molecular Formula: | C25 H31 N O7 |
| Smiles: | CCOc1cc(ccc1O)C1C(=C(C)NC2CC(C)C(C(C1=2)=O)C(=O)OC)C(=O)OC(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5189 |
| logD: | -0.3151 |
| logSw: | -3.3042 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.185 |
| InChI Key: | KFQROEKXKTVJNZ-UHFFFAOYSA-N |