2,3-diethoxy-13-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Chemical Structure Depiction of
2,3-diethoxy-13-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
2,3-diethoxy-13-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
| Compound ID: | C289-0078 |
| Compound Name: | 2,3-diethoxy-13-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
| Molecular Weight: | 526.64 |
| Molecular Formula: | C31 H34 N4 O4 |
| Smiles: | CCOc1cc2CCN3C(C(C(N4CCN(CC4)c4ccccn4)=O)c4ccccc4C3=O)c2cc1OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1594 |
| logD: | 3.1506 |
| logSw: | -3.3838 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.786 |
| InChI Key: | MRGRBYGCFQDWPJ-UHFFFAOYSA-N |