6-methyl 3-propyl 4-(3-chloro-5-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-propyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
6-methyl 3-propyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
Compound ID: | C142-0146 |
Compound Name: | 6-methyl 3-propyl 4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
Molecular Weight: | 491.97 |
Molecular Formula: | C25 H30 Cl N O7 |
Smiles: | CCCOC(C1C(C2=C(CC(C)C(C2=O)C(=O)OC)NC=1C)c1cc(c(c(c1)[Cl])O)OCC)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.9 |
logD: | 1.066 |
logSw: | -4.5753 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.731 |
InChI Key: | ZCBANYVKKBWWQY-UHFFFAOYSA-N |