6-methyl 3-{2-[(propan-2-yl)oxy]ethyl} 4-(3-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
6-methyl 3-{2-[(propan-2-yl)oxy]ethyl} 4-(3-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
6-methyl 3-{2-[(propan-2-yl)oxy]ethyl} 4-(3-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | C142-0048 |
| Compound Name: | 6-methyl 3-{2-[(propan-2-yl)oxy]ethyl} 4-(3-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: | CC1CC2=C(C(C(=C(C)N2)C(=O)OCCOC(C)C)c2cccc(c2)O)C(C1C(=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7914 |
| logD: | -1.0427 |
| logSw: | -2.9175 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.86 |
| InChI Key: | AKYMVJSQYVFXRS-UHFFFAOYSA-N |