[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
[4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | L867-0518 |
| Compound Name: | [4-(2-oxopyrrolidin-1-yl)phenyl]methyl 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 456.47 |
| Molecular Formula: | C27 H21 F N2 O4 |
| Smiles: | C1CC(N(C1)c1ccc(COC(C2=CN(C(c3ccccc23)=O)c2cccc(c2)F)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6503 |
| logD: | 3.6503 |
| logSw: | -3.9603 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.429 |
| InChI Key: | BVTJKEIGGOEUTE-UHFFFAOYSA-N |