N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(2,5,7-trimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)acetamide
Chemical Structure Depiction of
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(2,5,7-trimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)acetamide
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(2,5,7-trimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)acetamide
Compound characteristics
| Compound ID: | C561-2048 |
| Compound Name: | N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(2,5,7-trimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)acetamide |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C26 H28 N4 O S |
| Smiles: | Cc1c(CC(NCCc2ccc(cc2)SC)=O)c(C)n2c(c(c3ccccc3)c(C)n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0418 |
| logD: | 4.0417 |
| logSw: | -4.3688 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.886 |
| InChI Key: | CYQSEDYMOCVKGB-UHFFFAOYSA-N |