3-[1-(benzenesulfonyl)piperidin-3-yl]-1-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Chemical Structure Depiction of
3-[1-(benzenesulfonyl)piperidin-3-yl]-1-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
3-[1-(benzenesulfonyl)piperidin-3-yl]-1-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Compound characteristics
| Compound ID: | M305-2231 |
| Compound Name: | 3-[1-(benzenesulfonyl)piperidin-3-yl]-1-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C23 H28 N2 O3 S |
| Smiles: | C1CC(CCC(N2CCc3ccccc3C2)=O)CN(C1)S(c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5454 |
| logD: | 3.5454 |
| logSw: | -3.7397 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.666 |
| InChI Key: | DUQFWAXAZWCLAF-LJQANCHMSA-N |