N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(pyridin-2-yl)pyridazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(pyridin-2-yl)pyridazin-3-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(pyridin-2-yl)pyridazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | E548-0097 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(pyridin-2-yl)pyridazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 366.4 |
| Molecular Formula: | C18 H14 N4 O3 S |
| Smiles: | C1Oc2ccc(cc2O1)NC(CSc1ccc(c2ccccn2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3504 |
| logD: | 2.3431 |
| logSw: | -2.8839 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.112 |
| InChI Key: | QLYWHZKFQCJIEI-UHFFFAOYSA-N |