5-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Chemical Structure Depiction of
5-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
5-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Compound characteristics
| Compound ID: | L926-0352 |
| Compound Name: | 5-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
| Molecular Weight: | 420.4 |
| Molecular Formula: | C19 H12 N6 O4 S |
| Smiles: | C(c1nc(c2ccc3c(c2)OCO3)no1)N1C(c2cc(c3cccs3)nn2C=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9682 |
| logD: | 2.9682 |
| logSw: | -3.2533 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.622 |
| InChI Key: | LQMGYRRDVLQOSD-UHFFFAOYSA-N |