N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-ethylbenzenesulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-ethylbenzenesulfonamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-ethylbenzenesulfonamide
Compound characteristics
Compound ID: | Y050-0874 |
Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-ethylbenzenesulfonamide |
Molecular Weight: | 358.46 |
Molecular Formula: | C19 H22 N2 O3 S |
Smiles: | CCN(CC(N1CCc2ccccc2C1)=O)S(c1ccccc1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6579 |
logD: | 2.6579 |
logSw: | -2.8402 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 47.393 |
InChI Key: | MVRWVMTWTZGFGI-UHFFFAOYSA-N |