methyl 2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
Compound ID: | 8008-3374 |
Compound Name: | methyl 2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
Molecular Weight: | 317.4 |
Molecular Formula: | C17 H19 N O3 S |
Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1ccc(C)s1)C(=O)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1923 |
logD: | -0.8559 |
logSw: | -3.4867 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.113 |
InChI Key: | UAYKWJVPIZXBGS-INIZCTEOSA-N |