13-(4-ethylpiperazine-1-carbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Chemical Structure Depiction of
13-(4-ethylpiperazine-1-carbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
13-(4-ethylpiperazine-1-carbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
| Compound ID: | C265-0326 |
| Compound Name: | 13-(4-ethylpiperazine-1-carbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C26 H31 N3 O4 |
| Smiles: | CCN1CCN(CC1)C(C1C2c3cc(c(cc3CCN2C(c2ccccc12)=O)OC)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7281 |
| logD: | 1.3196 |
| logSw: | -2.4746 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.392 |
| InChI Key: | SZHJEXUDCQAYQR-UHFFFAOYSA-N |