13-[4-(2,5-dimethylphenyl)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-(2,5-dimethylphenyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
13-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
| Compound ID: | C066-2335 |
| Compound Name: | 13-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
| Molecular Weight: | 525.65 |
| Molecular Formula: | C32 H35 N3 O4 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(C1C2c3ccccc3CCN2C(c2cc(c(cc12)OC)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9487 |
| logD: | 4.9487 |
| logSw: | -4.5823 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.815 |
| InChI Key: | SGFPCYPGUFNWBO-UHFFFAOYSA-N |