CAS 1222102-51-3: 2-Piperazinone, 4-[(3R)-3-amino-1-oxo-4-(2,4,5-trifluorophenyl)butyl]-3-[(1,1-dimethylethoxy)methyl]-, (3R)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
Description:2-Piperazinone, 4-[(3R)-3-amino-1-oxo-4-(2,4,5-trifluorophenyl)butyl]-3-[(1,1-dimethylethoxy)methyl]-, (3R)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) is a complex organic compound characterized by its piperazinone core, which is a cyclic amide structure. This substance features multiple functional groups, including an amino group, a ketone, and a dihydroxybutanedioate moiety, contributing to its potential biological activity. The presence of trifluorophenyl groups suggests enhanced lipophilicity and potential interactions with biological targets. The compound's stereochemistry, indicated by the (3R) and (2R,3R) designations, implies specific spatial arrangements that may influence its pharmacological properties. Additionally, the presence of the dimethylethoxy group may enhance solubility and stability. Overall, this compound's intricate structure and functional diversity suggest potential applications in medicinal chemistry, particularly in the development of therapeutics targeting specific biological pathways. However, detailed studies would be necessary to fully elucidate its properties and potential uses.
Formula:C19H26F3N3O3·C4H6O6
InChI:InChI=1S/C19H26F3N3O3.C4H6O6/c1-19(2,3)28-10-16-18(27)24-4-5-25(16)17(26)8-12(23)6-11-7-14(21)15(22)9-13(11)20;5-1(3(7)8)2(6)4(9)10/h7,9,12,16H,4-6,8,10,23H2,1-3H3,(H,24,27);1-2,5-6H,(H,7,8)(H,9,10)/t12-,16-;1-,2-/m11/s1
InChI key:InChIKey=RBBXDAJRSNHIJZ-DLDKMZOSSA-N
SMILES:O=C(O)C(O)C(O)C(=O)O.O=C1NCCN(C(=O)CC(N)CC2=CC(F)=C(F)C=C2F)C1COC(C)(C)C
- Synonyms:
- 2-Piperazinone, 4-[(3R)-3-amino-1-oxo-4-(2,4,5-trifluorophenyl)butyl]-3-[(1,1-dimethylethoxy)methyl]-, (3R)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
