2,3-diethoxy-13-[4-(furan-2-carbonyl)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-(furan-2-carbonyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
2,3-diethoxy-13-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
| Compound ID: | C289-0171 |
| Compound Name: | 2,3-diethoxy-13-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
| Molecular Weight: | 543.62 |
| Molecular Formula: | C31 H33 N3 O6 |
| Smiles: | CCOc1cc2CCN3C(C(C(N4CCN(CC4)C(c4ccco4)=O)=O)c4ccccc4C3=O)c2cc1OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0647 |
| logD: | 2.0647 |
| logSw: | -2.9512 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.049 |
| InChI Key: | GZQVLGLLROPWPQ-UHFFFAOYSA-N |