methyl 4-(4-ethoxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-(4-ethoxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 4-(4-ethoxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
Compound ID: | 1781-2016 |
Compound Name: | methyl 4-(4-ethoxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
Molecular Weight: | 399.49 |
Molecular Formula: | C23 H29 N O5 |
Smiles: | CCOc1ccc(cc1OC)C1C(=C(C)NC2CC(C)(C)CC(C1=2)=O)C(=O)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3845 |
logD: | -0.9026 |
logSw: | -3.5728 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.936 |
InChI Key: | RPHPTPVFMSKOSY-FQEVSTJZSA-N |