6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-4-(morpholine-4-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-4-(morpholine-4-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-4-(morpholine-4-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C197-0099 |
| Compound Name: | 6,7-dimethoxy-2-methyl-3-[4-(methylsulfanyl)phenyl]-4-(morpholine-4-carbonyl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C24 H28 N2 O5 S |
| Smiles: | CN1C(C(C(N2CCOCC2)=O)c2cc(c(cc2C1=O)OC)OC)c1ccc(cc1)SC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2878 |
| logD: | 2.2878 |
| logSw: | -2.9941 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.506 |
| InChI Key: | LQQRFSCOGDXRHJ-UHFFFAOYSA-N |