(2H-1,3-benzodioxol-5-yl)[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]methanone
(2H-1,3-benzodioxol-5-yl)[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]methanone
Compound characteristics
| Compound ID: | K407-0609 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]methanone |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C29 H31 N O6 |
| Smiles: | CC(C)c1ccc(cc1)OCC1c2cc(c(cc2CCN1C(c1ccc2c(c1)OCO2)=O)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3496 |
| logD: | 5.3496 |
| logSw: | -5.461 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.689 |
| InChI Key: | YHHGOMQAJXHSTQ-DEOSSOPVSA-N |