ethyl 1-{3-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanoyl}piperidine-4-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 1-{3-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanoyl}piperidine-4-carboxylate--hydrogen chloride (1/1)
ethyl 1-{3-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanoyl}piperidine-4-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E591-0784 |
| Compound Name: | ethyl 1-{3-[6-(piperidin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanoyl}piperidine-4-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 450.97 |
| Molecular Formula: | C21 H30 N6 O3 |
| Salt: | HCl |
| Smiles: | CCOC(C1CCN(CC1)C(CCc1nnc2ccc(nn12)N1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6439 |
| logD: | 1.6439 |
| logSw: | -1.9427 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.435 |
| InChI Key: | ATIPNDFPOLKVAX-UHFFFAOYSA-N |