3-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Chemical Structure Depiction of
3-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
3-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Compound characteristics
| Compound ID: | C561-0773 |
| Compound Name: | 3-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C27 H29 F N4 O S |
| Smiles: | Cc1c(CCC(NCCc2ccc(cc2)SC)=O)c(C)n2c(c(c3ccc(cc3)F)c(C)n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3549 |
| logD: | 4.3531 |
| logSw: | -4.4736 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.886 |
| InChI Key: | MHUBRMSWPNVMTN-UHFFFAOYSA-N |