3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(4-nitrophenyl)pyrrolidine-2,5-dione
Chemical Structure Depiction of
3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(4-nitrophenyl)pyrrolidine-2,5-dione
3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(4-nitrophenyl)pyrrolidine-2,5-dione
Compound characteristics
Compound ID: | Y020-5638 |
Compound Name: | 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(4-nitrophenyl)pyrrolidine-2,5-dione |
Molecular Weight: | 351.36 |
Molecular Formula: | C19 H17 N3 O4 |
Smiles: | C1CN(Cc2ccccc12)C1CC(N(C1=O)c1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0977 |
logD: | 2.0977 |
logSw: | -2.5827 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 65.031 |
InChI Key: | DCLRQEYOQACJGG-QGZVFWFLSA-N |