4-amino-5-{[(pyridin-4-yl)methyl]sulfanyl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-amino-5-{[(pyridin-4-yl)methyl]sulfanyl}-4H-1,2,4-triazole-3-thiol
4-amino-5-{[(pyridin-4-yl)methyl]sulfanyl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8016-7924 |
| Compound Name: | 4-amino-5-{[(pyridin-4-yl)methyl]sulfanyl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 239.32 |
| Molecular Formula: | C8 H9 N5 S2 |
| Smiles: | C(c1ccncc1)Sc1nnc(n1N)S |
| Stereo: | ACHIRAL |
| logP: | -0.1846 |
| logD: | -0.4588 |
| logSw: | -0.834 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 50.895 |
| InChI Key: | SDCCFGGMUIOZJZ-UHFFFAOYSA-N |