3-phenyl-7-(thiophen-2-yl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Chemical Structure Depiction of
3-phenyl-7-(thiophen-2-yl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
3-phenyl-7-(thiophen-2-yl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Compound characteristics
| Compound ID: | D727-0283 |
| Compound Name: | 3-phenyl-7-(thiophen-2-yl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one |
| Molecular Weight: | 312.37 |
| Molecular Formula: | C14 H8 N4 O S2 |
| Smiles: | c1ccc(cc1)C1C(N2C(=NN=1)SC(c1cccs1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3267 |
| logD: | 3.3266 |
| logSw: | -3.4887 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.843 |
| InChI Key: | HULSJOGOOAUCIY-UHFFFAOYSA-N |