1-(4-{[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperidin-1-yl)-2-{[3-(pyridin-3-yl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]amino}ethan-1-one
Chemical Structure Depiction of
1-(4-{[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperidin-1-yl)-2-{[3-(pyridin-3-yl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]amino}ethan-1-one
1-(4-{[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperidin-1-yl)-2-{[3-(pyridin-3-yl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]amino}ethan-1-one
Compound characteristics
| Compound ID: | S428-1128 |
| Compound Name: | 1-(4-{[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]methyl}piperidin-1-yl)-2-{[3-(pyridin-3-yl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]amino}ethan-1-one |
| Molecular Weight: | 503.56 |
| Molecular Formula: | C25 H29 N9 O3 |
| Smiles: | C1CN(CCC1Cc1nc(C2CCOCC2)no1)C(CNc1ccc2nnc(c3cccnc3)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8915 |
| logD: | 1.8908 |
| logSw: | -1.817 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.281 |
| InChI Key: | IMOSZJMIHIGIPL-UHFFFAOYSA-N |