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CAS 1246960-27-9

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2-Piperazinone, 4-[(3R)-3-amino-1-oxo-4-(2,4,5-trifluorophenyl)butyl]-3-[(1,1-dimethylethoxy)methyl]-, hydrochloride (1:1), (3R)-

Description:
2-Piperazinone, 4-[(3R)-3-amino-1-oxo-4-(2,4,5-trifluorophenyl)butyl]-3-[(1,1-dimethylethoxy)methyl]-, hydrochloride (1:1) is a chemical compound characterized by its complex structure, which includes a piperazinone core and various functional groups that contribute to its biological activity. The presence of a trifluorophenyl group suggests potential lipophilicity, which may enhance its ability to penetrate biological membranes. The compound also features an amino group, indicating potential for hydrogen bonding and interaction with biological targets. As a hydrochloride salt, it is likely to be more soluble in water, facilitating its use in pharmaceutical formulations. The specific stereochemistry indicated by the (3R) designation suggests that the compound may exhibit chiral properties, which can influence its pharmacodynamics and pharmacokinetics. Overall, this compound may have 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·ClH
InChI:InChI=1S/C19H26F3N3O3.ClH/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;/h7,9,12,16H,4-6,8,10,23H2,1-3H3,(H,24,27);1H/t12-,16-;/m1./s1
InChI key:InChIKey=QHQXWMKKQNSBTC-VQZRABBESA-N
SMILES:C(C[C@@H](CC1=C(F)C=C(F)C(F)=C1)N)(=O)N2[C@H](COC(C)(C)C)C(=O)NCC2.Cl
Synonyms:
  • 2-Piperazinone, 4-[(3R)-3-amino-1-oxo-4-(2,4,5-trifluorophenyl)butyl]-3-[(1,1-dimethylethoxy)methyl]-, hydrochloride (1:1), (3R)-
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