2-{[6-(3,4-dihydroisoquinolin-2(1H)-yl)pyridazin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[6-(3,4-dihydroisoquinolin-2(1H)-yl)pyridazin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
2-{[6-(3,4-dihydroisoquinolin-2(1H)-yl)pyridazin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F814-1680 |
| Compound Name: | 2-{[6-(3,4-dihydroisoquinolin-2(1H)-yl)pyridazin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Smiles: | COc1cccc(c1)NC(CSc1ccc(nn1)N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1895 |
| logD: | 4.1895 |
| logSw: | -4.2265 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.342 |
| InChI Key: | XGSVNQUDYJDJCF-UHFFFAOYSA-N |