1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[(isoquinolin-1-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[(isoquinolin-1-yl)sulfanyl]ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[(isoquinolin-1-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8019-8900 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[(isoquinolin-1-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 334.44 |
| Molecular Formula: | C20 H18 N2 O S |
| Smiles: | C1CN(Cc2ccccc12)C(CSc1c2ccccc2ccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8934 |
| logD: | 3.8925 |
| logSw: | -3.8712 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.929 |
| InChI Key: | MTKAEURZDSEUSA-UHFFFAOYSA-N |