N-(2H-1,3-benzodioxol-5-yl)-2,3-dimethoxy-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2,3-dimethoxy-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-2,3-dimethoxy-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Compound characteristics
| Compound ID: | C265-0317 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2,3-dimethoxy-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide |
| Molecular Weight: | 472.5 |
| Molecular Formula: | C27 H24 N2 O6 |
| Smiles: | COc1cc2CCN3C(C(C(Nc4ccc5c(c4)OCO5)=O)c4ccccc4C3=O)c2cc1OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0839 |
| logD: | 3.082 |
| logSw: | -3.5834 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.413 |
| InChI Key: | SMZFCQMJSFHSMZ-UHFFFAOYSA-N |