5-(4-chloroanilino)[1,2,5]oxadiazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrazine-8-thiol
Chemical Structure Depiction of
5-(4-chloroanilino)[1,2,5]oxadiazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrazine-8-thiol
5-(4-chloroanilino)[1,2,5]oxadiazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrazine-8-thiol
Compound characteristics
| Compound ID: | 8004-2058 |
| Compound Name: | 5-(4-chloroanilino)[1,2,5]oxadiazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrazine-8-thiol |
| Molecular Weight: | 319.73 |
| Molecular Formula: | C11 H6 Cl N7 O S |
| Smiles: | c1cc(ccc1Nc1c2nnc(n2c2c(n1)non2)S)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.8369 |
| logD: | 2.8321 |
| logSw: | -3.6272 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.331 |
| InChI Key: | HJDQOHBHMAFNFA-UHFFFAOYSA-N |