N-(2H-1,3-benzodioxol-5-yl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F424-0782 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[4-oxo-2-(thiophen-2-yl)-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C18 H13 N5 O4 S2 |
| Smiles: | C1Oc2ccc(cc2O1)NC(CSC1=NNC(c2cc(c3cccs3)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9839 |
| logD: | 2.9823 |
| logSw: | -3.3788 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.598 |
| InChI Key: | PNSSHDKRSWYOKI-UHFFFAOYSA-N |