7-(benzylsulfanyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Chemical Structure Depiction of
7-(benzylsulfanyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
7-(benzylsulfanyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Compound characteristics
| Compound ID: | G856-3794 |
| Compound Name: | 7-(benzylsulfanyl)-3-methyl-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one |
| Molecular Weight: | 290.36 |
| Molecular Formula: | C12 H10 N4 O S2 |
| Smiles: | CC1C(N2C(=NN=1)SC(=N2)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8948 |
| logD: | 2.8554 |
| logSw: | -3.1672 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.689 |
| InChI Key: | HYPSUBDPZHEVIG-UHFFFAOYSA-N |