[(5-amino-7-hydroxy[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetonitrile
Chemical Structure Depiction of
[(5-amino-7-hydroxy[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetonitrile
[(5-amino-7-hydroxy[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetonitrile
Compound characteristics
| Compound ID: | 8014-9474 |
| Compound Name: | [(5-amino-7-hydroxy[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetonitrile |
| Molecular Weight: | 222.22 |
| Molecular Formula: | C7 H6 N6 O S |
| Smiles: | C(C#N)Sc1nnc2nc(cc(N)n12)O |
| Stereo: | ACHIRAL |
| logP: | -0.6358 |
| logD: | -0.8516 |
| logSw: | -0.864 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.83 |
| InChI Key: | UPTCPLAJBGGGDV-UHFFFAOYSA-N |