3-[6-(diethylamino)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Chemical Structure Depiction of
3-[6-(diethylamino)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
3-[6-(diethylamino)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Compound characteristics
| Compound ID: | E591-0750 |
| Compound Name: | 3-[6-(diethylamino)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide |
| Molecular Weight: | 412.56 |
| Molecular Formula: | C21 H28 N6 O S |
| Smiles: | CCN(CC)c1ccc2nnc(CCC(NCCc3ccc(cc3)SC)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3604 |
| logD: | 2.3604 |
| logSw: | -2.7619 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.886 |
| InChI Key: | OKMGGUOKGXFCKM-UHFFFAOYSA-N |