3-{[(pyridin-4-yl)methyl]sulfanyl}-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Chemical Structure Depiction of
3-{[(pyridin-4-yl)methyl]sulfanyl}-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
3-{[(pyridin-4-yl)methyl]sulfanyl}-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Compound characteristics
| Compound ID: | 8018-0793 |
| Compound Name: | 3-{[(pyridin-4-yl)methyl]sulfanyl}-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole |
| Molecular Weight: | 232.26 |
| Molecular Formula: | C9 H8 N6 S |
| Smiles: | C(c1ccncc1)Sc1nnc2[nH]cnn12 |
| Stereo: | ACHIRAL |
| logP: | -0.4436 |
| logD: | -0.8868 |
| logSw: | -1.0937 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.75 |
| InChI Key: | GBTLZAJYMUUEEQ-UHFFFAOYSA-N |