[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(4-ethoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(4-ethoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(4-ethoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
Compound ID: | L867-0454 |
Compound Name: | [4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(4-ethoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
Molecular Weight: | 482.54 |
Molecular Formula: | C29 H26 N2 O5 |
Smiles: | CCOc1ccc(cc1)N1C=C(C(=O)OCc2ccc(cc2)N2CCCC2=O)c2ccccc2C1=O |
Stereo: | ACHIRAL |
logP: | 3.9286 |
logD: | 3.9286 |
logSw: | -4.0432 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.552 |
InChI Key: | GECSVLPEMVXXGS-UHFFFAOYSA-N |