N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-methyl-7-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-methyl-7-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetamide
N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-methyl-7-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G856-6715 |
| Compound Name: | N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-methyl-7-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 320.33 |
| Molecular Formula: | C12 H12 N6 O3 S |
| Smiles: | CC1=CC(Nc2nnc(n12)SCC(Nc1cc(C)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.645 |
| logD: | 0.6289 |
| logSw: | -2.1756 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.642 |
| InChI Key: | HZWDWABVYGJSQF-UHFFFAOYSA-N |