2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-[3-(piperidin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-[3-(piperidin-1-yl)propyl]acetamide
2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-[3-(piperidin-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | C179-0941 |
| Compound Name: | 2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-[3-(piperidin-1-yl)propyl]acetamide |
| Molecular Weight: | 452.62 |
| Molecular Formula: | C24 H32 N6 O S |
| Smiles: | Cc1c(Cc2ccccc2)c(C)n2c(n1)nc(n2)SCC(NCCCN1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8721 |
| logD: | 0.2179 |
| logSw: | -3.1544 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.85 |
| InChI Key: | RWOFROLJBGYNJS-UHFFFAOYSA-N |