4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-N-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-N-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-N-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
Compound ID: | C230-0257 |
Compound Name: | 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-N-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide |
Molecular Weight: | 589.09 |
Molecular Formula: | C33 H33 Cl N2 O6 |
Smiles: | CC1=C(C(C2=C(CC(CC2=O)c2ccc(c(c2)OC)OC)N1)c1cc(c(c(c1)[Cl])O)OC)C(Nc1ccc(C)cc1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.922 |
logD: | 3.7877 |
logSw: | -5.8134 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 85.111 |
InChI Key: | JYBMJDQRLZYXQR-UHFFFAOYSA-N |