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CAS 892491-98-4

:

1,1-Dimethylethyl 4-(5-amino-2-pyrimidinyl)-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl 4-(5-amino-2-pyrimidinyl)-1-piperazinecarboxylate, identified by its CAS number 892491-98-4, is a chemical compound that features a piperazine ring, which is a six-membered cyclic amine, and a pyrimidine moiety, known for its role in various biological activities. This compound is characterized by the presence of a tert-butyl group (1,1-dimethylethyl) that enhances its lipophilicity, potentially influencing its pharmacokinetic properties. The amino group on the pyrimidine ring suggests potential for hydrogen bonding, which may contribute to its interactions with biological targets. The carboxylate functional group indicates that it can exist in both protonated and deprotonated forms, depending on the pH of the environment. This compound may exhibit biological activity, making it of interest in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific receptors or enzymes. Its structural features suggest potential applications in drug design, especially in areas related to neuropharmacology or oncology, although specific biological activities would require further investigation.
Formula:C13H21N5O2
InChI:InChI=1S/C13H21N5O2/c1-13(2,3)20-12(19)18-6-4-17(5-7-18)11-15-8-10(14)9-16-11/h8-9H,4-7,14H2,1-3H3
InChI key:InChIKey=UOFXCDLVMBOPFE-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CCN(CC1)C=2N=CC(N)=CN2
Synonyms:
  • tert-Butyl 4-(5-aminopyrimidin-2-yl)piperazine-1-carboxylate
  • 1,1-Dimethylethyl 4-(5-amino-2-pyrimidinyl)-1-piperazinecarboxylate
  • 4-(5-Aminopyrimidin-2-yl)piperazine-1-carboxylic acid tert-butyl ester
  • 1-Piperazinecarboxylic acid, 4-(5-amino-2-pyrimidinyl)-, 1,1-dimethylethyl ester
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