6,7-dimethoxy-3-(4-methoxyphenyl)-2-methyl-4-(3-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
6,7-dimethoxy-3-(4-methoxyphenyl)-2-methyl-4-(3-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
6,7-dimethoxy-3-(4-methoxyphenyl)-2-methyl-4-(3-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C115-0473 |
| Compound Name: | 6,7-dimethoxy-3-(4-methoxyphenyl)-2-methyl-4-(3-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C26 H32 N2 O5 |
| Smiles: | CC1CCCN(C1)C(C1C(c2ccc(cc2)OC)N(C)C(c2cc(c(cc12)OC)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0254 |
| logD: | 3.0254 |
| logSw: | -3.2655 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.075 |
| InChI Key: | VXHMIKBXIWUMIW-UHFFFAOYSA-N |