3-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methoxy-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methoxy-N-methylbenzene-1-sulfonamide
3-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methoxy-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y050-0118 |
| Compound Name: | 3-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methoxy-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 408.9 |
| Molecular Formula: | C19 H21 Cl N2 O4 S |
| Smiles: | CN(CC(N1CCc2ccccc2C1)=O)S(c1ccc(c(c1)[Cl])OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8178 |
| logD: | 2.8178 |
| logSw: | -3.3627 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.487 |
| InChI Key: | XRWBDUGNYJIAAG-UHFFFAOYSA-N |