2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C592-3891 |
| Compound Name: | 2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 324.42 |
| Molecular Formula: | C12 H16 N6 O S2 |
| Smiles: | Cc1cc(C)nc(n1)SCc1nnc(n1C)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2163 |
| logD: | 0.2159 |
| logSw: | -1.294 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.592 |
| InChI Key: | KZDSOWZBUQGCPS-UHFFFAOYSA-N |