3-(butan-2-yl) 6-methyl 4-(2-ethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
3-(butan-2-yl) 6-methyl 4-(2-ethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
3-(butan-2-yl) 6-methyl 4-(2-ethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
Compound ID: | C142-0371 |
Compound Name: | 3-(butan-2-yl) 6-methyl 4-(2-ethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
Molecular Weight: | 455.55 |
Molecular Formula: | C26 H33 N O6 |
Smiles: | CCC(C)OC(C1C(C2=C(CC(C)C(C2=O)C(=O)OC)NC=1C)c1ccccc1OCC)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.1422 |
logD: | 1.3082 |
logSw: | -5.0212 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.52 |
InChI Key: | FONXOOKAIPWHAR-UHFFFAOYSA-N |