13-[4-(4-acetylphenyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Chemical Structure Depiction of
13-[4-(4-acetylphenyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
13-[4-(4-acetylphenyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
| Compound ID: | C240-0174 |
| Compound Name: | 13-[4-(4-acetylphenyl)piperazine-1-carbonyl]-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C30 H29 N3 O3 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(C1C2c3ccccc3CCN2C(c2ccccc12)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7143 |
| logD: | 3.7143 |
| logSw: | -3.8564 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.681 |
| InChI Key: | SQJUYYRSDVCEDI-UHFFFAOYSA-N |