N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}-5-fluoro-2-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}-5-fluoro-2-methoxybenzene-1-sulfonamide
N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}-5-fluoro-2-methoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G501-0432 |
| Compound Name: | N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}-5-fluoro-2-methoxybenzene-1-sulfonamide |
| Molecular Weight: | 483.6 |
| Molecular Formula: | C26 H30 F N3 O3 S |
| Smiles: | CN(C)c1ccc(cc1)C(CNS(c1cc(ccc1OC)F)(=O)=O)N1CCc2ccccc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6688 |
| logD: | 4.6641 |
| logSw: | -4.3586 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.083 |
| InChI Key: | NJKDDYMMJHAWQN-DEOSSOPVSA-N |