2-(methylsulfanyl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(methylsulfanyl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(methylsulfanyl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | 7752-0316 |
| Compound Name: | 2-(methylsulfanyl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 258.3 |
| Molecular Formula: | C12 H10 N4 O S |
| Smiles: | CSc1nc2NC(=CC(n2n1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3103 |
| logD: | 0.8913 |
| logSw: | -2.9805 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.957 |
| InChI Key: | GSHMWZICZVJZCJ-UHFFFAOYSA-N |