3-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-butyl-N-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-amine
Chemical Structure Depiction of
3-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-butyl-N-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-amine
3-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-butyl-N-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-amine
Compound characteristics
| Compound ID: | L550-0340 |
| Compound Name: | 3-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-N-butyl-N-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-amine |
| Molecular Weight: | 421.46 |
| Molecular Formula: | C21 H23 N7 O3 |
| Smiles: | CCCCN(C)c1ccc2nnc(CCc3nc(c4ccc5c(c4)OCO5)no3)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7469 |
| logD: | 3.7469 |
| logSw: | -3.8369 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.5 |
| InChI Key: | HYYLETGOXFYPNT-UHFFFAOYSA-N |