3-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Chemical Structure Depiction of
3-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
3-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Compound characteristics
| Compound ID: | G395-1247 |
| Compound Name: | 3-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide |
| Molecular Weight: | 482.6 |
| Molecular Formula: | C24 H30 N6 O3 S |
| Smiles: | CSc1ccc(CCNC(CCc2nnc3ccc(nn23)N2CCC3(CC2)OCCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6951 |
| logD: | 1.6951 |
| logSw: | -2.3819 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.039 |
| InChI Key: | HQTTWAYOHXRYQM-UHFFFAOYSA-N |