10,11-dimethoxy-8-oxo-N-[(pyridin-2-yl)methyl]-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Chemical Structure Depiction of
10,11-dimethoxy-8-oxo-N-[(pyridin-2-yl)methyl]-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
10,11-dimethoxy-8-oxo-N-[(pyridin-2-yl)methyl]-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Compound characteristics
Compound ID: | C066-2162 |
Compound Name: | 10,11-dimethoxy-8-oxo-N-[(pyridin-2-yl)methyl]-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide |
Molecular Weight: | 443.5 |
Molecular Formula: | C26 H25 N3 O4 |
Smiles: | COc1cc2C(C3c4ccccc4CCN3C(c2cc1OC)=O)C(NCc1ccccn1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.3587 |
logD: | 2.3585 |
logSw: | -2.9481 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.163 |
InChI Key: | CIMYZTSCFXNYNE-UHFFFAOYSA-N |