3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Chemical Structure Depiction of
3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Compound characteristics
| Compound ID: | C561-2206 |
| Compound Name: | 3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxo-4,7-dihydropyrazolo[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: | CCN1C(C)=C(CCC(NCCc2ccc(cc2)SC)=O)C(n2c1cc(c1ccccc1OC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0499 |
| logD: | 4.0499 |
| logSw: | -4.1915 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.81 |
| InChI Key: | FBPBCBKJAZSLLM-UHFFFAOYSA-N |