2,3-diethoxy-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Chemical Structure Depiction of
2,3-diethoxy-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
2,3-diethoxy-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Compound characteristics
| Compound ID: | C289-0222 |
| Compound Name: | 2,3-diethoxy-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide |
| Molecular Weight: | 586.71 |
| Molecular Formula: | C34 H39 F N4 O4 |
| Smiles: | CCOc1cc2CCN3C(C(C(NCCN4CCN(CC4)c4ccccc4F)=O)c4ccccc4C3=O)c2cc1OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.191 |
| logD: | 3.1158 |
| logSw: | -3.6369 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.563 |
| InChI Key: | SNVWDHAQLHBAKK-UHFFFAOYSA-N |