ethyl 5-[2-(4-ethoxyphenyl)ethyl]-6-{[(4-fluorophenyl)methyl]carbamoyl}-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Chemical Structure Depiction of
ethyl 5-[2-(4-ethoxyphenyl)ethyl]-6-{[(4-fluorophenyl)methyl]carbamoyl}-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
ethyl 5-[2-(4-ethoxyphenyl)ethyl]-6-{[(4-fluorophenyl)methyl]carbamoyl}-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Compound characteristics
Compound ID: | E853-3438 |
Compound Name: | ethyl 5-[2-(4-ethoxyphenyl)ethyl]-6-{[(4-fluorophenyl)methyl]carbamoyl}-6-methyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate |
Molecular Weight: | 522.58 |
Molecular Formula: | C28 H31 F N4 O5 |
Smiles: | CCOC(c1cc2C(N(CCc3ccc(cc3)OCC)C(C)(Cn2n1)C(NCc1ccc(cc1)F)=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6366 |
logD: | 3.6366 |
logSw: | -3.7518 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.601 |
InChI Key: | KSUKDGKTIADANA-NDEPHWFRSA-N |