2-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)pyrazin-2-yl]sulfanyl}-N-(3-ethylphenyl)acetamide
Chemical Structure Depiction of
2-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)pyrazin-2-yl]sulfanyl}-N-(3-ethylphenyl)acetamide
2-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)pyrazin-2-yl]sulfanyl}-N-(3-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | L981-0746 |
| Compound Name: | 2-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)pyrazin-2-yl]sulfanyl}-N-(3-ethylphenyl)acetamide |
| Molecular Weight: | 404.53 |
| Molecular Formula: | C23 H24 N4 O S |
| Smiles: | CCc1cccc(c1)NC(CSc1c(nccn1)N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.788 |
| logD: | 4.788 |
| logSw: | -4.5084 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.391 |
| InChI Key: | NEIMKIYADPMYOZ-UHFFFAOYSA-N |