N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}-4-methoxy-3-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}-4-methoxy-3-methylbenzene-1-sulfonamide
N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}-4-methoxy-3-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G501-0424 |
| Compound Name: | N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}-4-methoxy-3-methylbenzene-1-sulfonamide |
| Molecular Weight: | 479.64 |
| Molecular Formula: | C27 H33 N3 O3 S |
| Smiles: | Cc1cc(ccc1OC)S(NCC(c1ccc(cc1)N(C)C)N1CCc2ccccc2C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1982 |
| logD: | 5.1936 |
| logSw: | -5.1943 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.083 |
| InChI Key: | KWVOZGLXDYZZCE-SANMLTNESA-N |