4-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-ethylbenzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-ethylbenzene-1-sulfonamide
4-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-ethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y050-0298 |
| Compound Name: | 4-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-ethylbenzene-1-sulfonamide |
| Molecular Weight: | 392.9 |
| Molecular Formula: | C19 H21 Cl N2 O3 S |
| Smiles: | CCN(CC(N1CCc2ccccc2C1)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4377 |
| logD: | 3.4377 |
| logSw: | -3.7207 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.393 |
| InChI Key: | SFRSMWKDVQZNNH-UHFFFAOYSA-N |