N-benzyl-3-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-benzyl-3-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methoxybenzene-1-sulfonamide
N-benzyl-3-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y050-0603 |
| Compound Name: | N-benzyl-3-chloro-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-4-methoxybenzene-1-sulfonamide |
| Molecular Weight: | 485 |
| Molecular Formula: | C25 H25 Cl N2 O4 S |
| Smiles: | COc1ccc(cc1[Cl])S(N(CC(N1CCc2ccccc2C1)=O)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3725 |
| logD: | 4.3725 |
| logSw: | -4.5794 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.027 |
| InChI Key: | IWMAFGVLNGHVTD-UHFFFAOYSA-N |