1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propan-1-one
Chemical Structure Depiction of
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propan-1-one
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propan-1-one
Compound characteristics
| Compound ID: | G395-0977 |
| Compound Name: | 1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propan-1-one |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C21 H25 N7 O3 |
| Smiles: | C(Cc1nnc2ccc(NCc3cccnc3)nn12)C(N1CCC2(CC1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | -0.4371 |
| logD: | -0.4663 |
| logSw: | -0.6783 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.522 |
| InChI Key: | KFWZYQBXXCDKTP-UHFFFAOYSA-N |