methyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
Compound ID: | 8011-5531 |
Compound Name: | methyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
Molecular Weight: | 365.35 |
Molecular Formula: | C19 H18 F3 N O3 |
Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1ccc(cc1)C(F)(F)F)C(=O)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6513 |
logD: | -0.2445 |
logSw: | -3.9807 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.095 |
InChI Key: | RTBXOPCSZVYUGQ-INIZCTEOSA-N |