1-[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]-2-(thiophen-2-yl)ethan-1-one
1-[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | K407-0431 |
| Compound Name: | 1-[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 465.61 |
| Molecular Formula: | C27 H31 N O4 S |
| Smiles: | CC(C)c1ccc(cc1)OCC1c2cc(c(cc2CCN1C(Cc1cccs1)=O)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.145 |
| logD: | 5.145 |
| logSw: | -5.0922 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.064 |
| InChI Key: | MBGBDINMCKWRPW-DEOSSOPVSA-N |