2-[6-(tert-butylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[6-(tert-butylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3,4-dimethoxyphenyl)acetamide
2-[6-(tert-butylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F804-1044 |
| Compound Name: | 2-[6-(tert-butylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 417.49 |
| Molecular Formula: | C19 H23 N5 O4 S |
| Smiles: | CC(C)(C)SC1C=CC2=NN(CC(Nc3ccc(c(c3)OC)OC)=O)C(N2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8932 |
| logD: | 2.8932 |
| logSw: | -3.3308 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.858 |
| InChI Key: | UBBTYIYECWRRQX-UHFFFAOYSA-N |