1-[2-(3,5-dimethylphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-[2-(3,5-dimethylphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-4-carboxamide
1-[2-(3,5-dimethylphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L227-1230 |
| Compound Name: | 1-[2-(3,5-dimethylphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-4-carboxamide |
| Molecular Weight: | 499.68 |
| Molecular Formula: | C29 H33 N5 O S |
| Smiles: | Cc1cc(C)cc(c1)c1cc2nc(C)cc(N3CCC(CC3)C(NCc3ccc(cc3)SC)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6787 |
| logD: | 3.5246 |
| logSw: | -5.4019 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.147 |
| InChI Key: | KGMJQHHPGZAGPV-UHFFFAOYSA-N |