[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(3-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(3-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(3-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | L867-0095 |
| Compound Name: | [4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(3-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C28 H24 N2 O4 |
| Smiles: | Cc1cccc(c1)N1C=C(C(=O)OCc2ccc(cc2)N2CCCC2=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.0732 |
| logD: | 4.0732 |
| logSw: | -4.3289 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.429 |
| InChI Key: | FDJKPQCUPOGPNV-UHFFFAOYSA-N |