10,11-dimethoxy-N-(2-methoxy-5-nitrophenyl)-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Chemical Structure Depiction of
10,11-dimethoxy-N-(2-methoxy-5-nitrophenyl)-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
10,11-dimethoxy-N-(2-methoxy-5-nitrophenyl)-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Compound characteristics
Compound ID: | C358-0080 |
Compound Name: | 10,11-dimethoxy-N-(2-methoxy-5-nitrophenyl)-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide |
Molecular Weight: | 503.51 |
Molecular Formula: | C27 H25 N3 O7 |
Smiles: | COc1ccc(cc1NC(C1C2c3ccccc3CCN2C(c2cc(c(cc12)OC)OC)=O)=O)[N+]([O-])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.7312 |
logD: | 3.1822 |
logSw: | -3.9239 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 94.612 |
InChI Key: | XRKMXOLPCYFBDE-UHFFFAOYSA-N |