2-[3-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[3-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
2-[3-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K978-0420 |
| Compound Name: | 2-[3-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C24 H28 N2 O5 |
| Smiles: | CC1c2cc(c(cc2CCN1C(CCN1C(C2C3CC(C=C3)C2C1=O)=O)=O)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1928 |
| logD: | 1.1928 |
| logSw: | -1.7711 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.805 |
| InChI Key: | IGEZAFVOCVYQQE-UHFFFAOYSA-N |