N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2,5-dimethoxy-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2,5-dimethoxy-N-methylbenzene-1-sulfonamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2,5-dimethoxy-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y050-0076 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2,5-dimethoxy-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 404.48 |
| Molecular Formula: | C20 H24 N2 O5 S |
| Smiles: | CN(CC(N1CCc2ccccc2C1)=O)S(c1cc(ccc1OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3585 |
| logD: | 2.3585 |
| logSw: | -2.8994 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.031 |
| InChI Key: | KPZCMHHVADLMNO-UHFFFAOYSA-N |