4-{1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl}-N,N-diethylbenzene-1-sulfonamide
Chemical Structure Depiction of
4-{1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl}-N,N-diethylbenzene-1-sulfonamide
4-{1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl}-N,N-diethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | K407-0304 |
| Compound Name: | 4-{1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl}-N,N-diethylbenzene-1-sulfonamide |
| Molecular Weight: | 566.72 |
| Molecular Formula: | C31 H38 N2 O6 S |
| Smiles: | CCN(CC)S(c1ccc(cc1)C(N1CCc2cc(c(cc2C1COc1cc(C)cc(C)c1)OC)OC)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9804 |
| logD: | 4.9804 |
| logSw: | -4.632 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.67 |
| InChI Key: | WGVCVOUOUZZKEQ-NDEPHWFRSA-N |