7-(3,4-difluorophenyl)-3-sulfanylidene-2,3-dihydro[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(3,4-difluorophenyl)-3-sulfanylidene-2,3-dihydro[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(3,4-difluorophenyl)-3-sulfanylidene-2,3-dihydro[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | C200-6719 |
| Compound Name: | 7-(3,4-difluorophenyl)-3-sulfanylidene-2,3-dihydro[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 280.25 |
| Molecular Formula: | C11 H6 F2 N4 O S |
| Smiles: | C1=CN(C(C2=NNC(N12)=S)=O)c1ccc(c(c1)F)F |
| Stereo: | ACHIRAL |
| logP: | 1.1635 |
| logD: | -1.8732 |
| logSw: | -2.2567 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.817 |
| InChI Key: | VZUDYGQHWGDDNL-UHFFFAOYSA-N |