1-[4-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl]-3-phenylpyrrolidine-2,5-dione
Chemical Structure Depiction of
1-[4-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl]-3-phenylpyrrolidine-2,5-dione
1-[4-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl]-3-phenylpyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | K807-3185 |
| Compound Name: | 1-[4-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl]-3-phenylpyrrolidine-2,5-dione |
| Molecular Weight: | 501.54 |
| Molecular Formula: | C28 H27 N3 O6 |
| Smiles: | CC1c2cc(c(cc2CCN1c1ccc(cc1[N+]([O-])=O)N1C(CC(C1=O)c1ccccc1)=O)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1808 |
| logD: | 3.1808 |
| logSw: | -3.5861 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.488 |
| InChI Key: | SHOHWHNDJHIHEM-UHFFFAOYSA-N |