N-cyclooctyl-6-methyl-5-[3-(methylsulfanyl)phenyl]-4-oxo-2-(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-6-methyl-5-[3-(methylsulfanyl)phenyl]-4-oxo-2-(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
N-cyclooctyl-6-methyl-5-[3-(methylsulfanyl)phenyl]-4-oxo-2-(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
Compound characteristics
| Compound ID: | E224-0971 |
| Compound Name: | N-cyclooctyl-6-methyl-5-[3-(methylsulfanyl)phenyl]-4-oxo-2-(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide |
| Molecular Weight: | 468.66 |
| Molecular Formula: | C26 H36 N4 O2 S |
| Smiles: | CC(C)c1cc2C(N(c3cccc(c3)SC)C(C)(Cn2n1)C(NC1CCCCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3082 |
| logD: | 5.3082 |
| logSw: | -5.1362 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.19 |
| InChI Key: | OBRBWQKFARZSLL-SANMLTNESA-N |