6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C197-0102 |
| Compound Name: | 6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-N-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 504.65 |
| Molecular Formula: | C29 H32 N2 O4 S |
| Smiles: | CC(C)c1ccc(cc1)NC(C1C(c2ccc(cc2)SC)N(C)C(c2cc(c(cc12)OC)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4702 |
| logD: | 5.4701 |
| logSw: | -5.4679 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.04 |
| InChI Key: | YBEYIKCOBVISJH-UHFFFAOYSA-N |