3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Chemical Structure Depiction of
3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Compound characteristics
| Compound ID: | C561-1468 |
| Compound Name: | 3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide |
| Molecular Weight: | 504.65 |
| Molecular Formula: | C28 H32 N4 O3 S |
| Smiles: | Cc1c(CCC(NCCc2ccc(cc2)SC)=O)c(C)n2c(cc(c3ccc(cc3OC)OC)n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.338 |
| logD: | 4.3284 |
| logSw: | -4.4027 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.937 |
| InChI Key: | YKTKBSXEVAIHIR-UHFFFAOYSA-N |