N~2~-[(4-butoxyphenyl)methyl]-N~6~-[(4-fluorophenyl)methyl]-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Chemical Structure Depiction of
N~2~-[(4-butoxyphenyl)methyl]-N~6~-[(4-fluorophenyl)methyl]-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
N~2~-[(4-butoxyphenyl)methyl]-N~6~-[(4-fluorophenyl)methyl]-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Compound characteristics
Compound ID: | E852-2524 |
Compound Name: | N~2~-[(4-butoxyphenyl)methyl]-N~6~-[(4-fluorophenyl)methyl]-5,6-dimethyl-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2,6-dicarboxamide |
Molecular Weight: | 521.59 |
Molecular Formula: | C28 H32 F N5 O4 |
Smiles: | CCCCOc1ccc(CNC(c2cc3C(N(C)C(C)(Cn3n2)C(NCc2ccc(cc2)F)=O)=O)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.433 |
logD: | 3.433 |
logSw: | -3.6651 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.613 |
InChI Key: | ZOEIMVCRWOPNHZ-NDEPHWFRSA-N |