7-{[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Chemical Structure Depiction of
7-{[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
7-{[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one
Compound characteristics
| Compound ID: | F835-0637 |
| Compound Name: | 7-{[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-2-(furan-2-yl)pyrazolo[1,5-d][1,2,4]triazin-4(5H)-one |
| Molecular Weight: | 396.38 |
| Molecular Formula: | C18 H12 N4 O5 S |
| Smiles: | C1Oc2ccc(cc2O1)C(CSC1=NNC(c2cc(c3ccco3)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6976 |
| logD: | 2.6947 |
| logSw: | -3.1071 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.255 |
| InChI Key: | BSBZVUGKLRHRKP-UHFFFAOYSA-N |