3-chloro-N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}benzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}benzene-1-sulfonamide
3-chloro-N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G501-0452 |
| Compound Name: | 3-chloro-N-{2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(dimethylamino)phenyl]ethyl}benzene-1-sulfonamide |
| Molecular Weight: | 470.03 |
| Molecular Formula: | C25 H28 Cl N3 O2 S |
| Smiles: | CN(C)c1ccc(cc1)C(CNS(c1cccc(c1)[Cl])(=O)=O)N1CCc2ccccc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3393 |
| logD: | 5.3346 |
| logSw: | -6.0981 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.453 |
| InChI Key: | COQUOFXYXKDRRK-VWLOTQADSA-N |