ethyl 6-(cyclooctylcarbamoyl)-5-(2,4-difluorophenyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Chemical Structure Depiction of
ethyl 6-(cyclooctylcarbamoyl)-5-(2,4-difluorophenyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
ethyl 6-(cyclooctylcarbamoyl)-5-(2,4-difluorophenyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Compound characteristics
| Compound ID: | E853-0780 |
| Compound Name: | ethyl 6-(cyclooctylcarbamoyl)-5-(2,4-difluorophenyl)-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate |
| Molecular Weight: | 488.53 |
| Molecular Formula: | C25 H30 F2 N4 O4 |
| Smiles: | CCOC(c1cc2C(N(c3ccc(cc3F)F)C(C)(Cn2n1)C(NC1CCCCCCC1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0787 |
| logD: | 4.0787 |
| logSw: | -4.1266 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.643 |
| InChI Key: | KKJHQLUBVQZRAY-VWLOTQADSA-N |