6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-N-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-N-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-N-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C197-0069 |
| Compound Name: | 6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-N-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C26 H27 N3 O4 S |
| Smiles: | CN1C(C(C(NCc2cccnc2)=O)c2cc(c(cc2C1=O)OC)OC)c1ccc(cc1)SC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3318 |
| logD: | 2.3294 |
| logSw: | -2.7299 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.88 |
| InChI Key: | ILHMZIOBGNAMHE-UHFFFAOYSA-N |