13-[4-(4-fluorophenyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Chemical Structure Depiction of
13-[4-(4-fluorophenyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
13-[4-(4-fluorophenyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
| Compound ID: | C358-0085 |
| Compound Name: | 13-[4-(4-fluorophenyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
| Molecular Weight: | 515.58 |
| Molecular Formula: | C30 H30 F N3 O4 |
| Smiles: | COc1cc2C(C3c4ccccc4CCN3C(c2cc1OC)=O)C(N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9414 |
| logD: | 3.9414 |
| logSw: | -3.9795 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.116 |
| InChI Key: | WVZDQGNUNAYINW-UHFFFAOYSA-N |