3-cycloheptyl 6-methyl 4-(4-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
3-cycloheptyl 6-methyl 4-(4-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
3-cycloheptyl 6-methyl 4-(4-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
Compound ID: | C142-0115 |
Compound Name: | 3-cycloheptyl 6-methyl 4-(4-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
Molecular Weight: | 469.55 |
Molecular Formula: | C27 H32 F N O5 |
Smiles: | CC1CC2=C(C(C(=C(C)N2)C(=O)OC2CCCCCC2)c2ccc(cc2)F)C(C1C(=O)OC)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.3992 |
logD: | 1.5652 |
logSw: | -5.3761 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.409 |
InChI Key: | MUWPSNOHIWEFDT-UHFFFAOYSA-N |