4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-N-[2-(phenylsulfanyl)ethyl]benzamide
Chemical Structure Depiction of
4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-N-[2-(phenylsulfanyl)ethyl]benzamide
4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-N-[2-(phenylsulfanyl)ethyl]benzamide
Compound characteristics
| Compound ID: | 5905-2751 |
| Compound Name: | 4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-N-[2-(phenylsulfanyl)ethyl]benzamide |
| Molecular Weight: | 402.56 |
| Molecular Formula: | C25 H26 N2 O S |
| Smiles: | C1CN(Cc2ccc(cc2)C(NCCSc2ccccc2)=O)Cc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.418 |
| logD: | 4.1374 |
| logSw: | -4.2537 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.8877 |
| InChI Key: | NMYAUBFFWNMDMZ-UHFFFAOYSA-N |