propyl 2,7,7-trimethyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propyl 2,7,7-trimethyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propyl 2,7,7-trimethyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
Compound ID: | 8011-8688 |
Compound Name: | propyl 2,7,7-trimethyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
Molecular Weight: | 357.45 |
Molecular Formula: | C21 H27 N O4 |
Smiles: | CCCOC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1ccc(C)o1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.1478 |
logD: | -0.2918 |
logSw: | -4.207 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.062 |
InChI Key: | KHABYOCUEVTHBL-IBGZPJMESA-N |