ethyl 5-(2H-1,3-benzodioxol-5-yl)-6-(cyclooctylcarbamoyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Chemical Structure Depiction of
ethyl 5-(2H-1,3-benzodioxol-5-yl)-6-(cyclooctylcarbamoyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
ethyl 5-(2H-1,3-benzodioxol-5-yl)-6-(cyclooctylcarbamoyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Compound characteristics
| Compound ID: | E853-0811 |
| Compound Name: | ethyl 5-(2H-1,3-benzodioxol-5-yl)-6-(cyclooctylcarbamoyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate |
| Molecular Weight: | 496.56 |
| Molecular Formula: | C26 H32 N4 O6 |
| Smiles: | CCOC(c1cc2C(N(c3ccc4c(c3)OCO4)C(C)(Cn2n1)C(NC1CCCCCCC1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9807 |
| logD: | 3.9807 |
| logSw: | -3.9395 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.059 |
| InChI Key: | MUYAIIINRQHXKJ-SANMLTNESA-N |