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CAS 1261234-68-7

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1,1-Dimethylethyl 4-(2-chloro-6-methyl-4-pyrimidinyl)-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl 4-(2-chloro-6-methyl-4-pyrimidinyl)-1-piperazinecarboxylate, identified by its CAS number 1261234-68-7, is a chemical compound that features a piperazine ring, which is a six-membered cyclic amine, and a pyrimidine moiety, characterized by its nitrogen-containing aromatic structure. This compound is typically classified as a piperazine derivative and may exhibit biological activity, potentially serving as a pharmacological agent. Its structure includes a tert-butyl group, which can influence its lipophilicity and solubility properties, making it relevant in medicinal chemistry. The presence of the chloro and methyl substituents on the pyrimidine ring can affect the compound's reactivity and interaction with biological targets. Additionally, the carboxylate functional group suggests potential for forming salts or esters, which can further modify its pharmacokinetic properties. Overall, this compound's unique structural features may contribute to its potential applications in drug development and therapeutic uses.
Formula:C14H21ClN4O2
InChI:InChI=1S/C14H21ClN4O2/c1-10-9-11(17-12(15)16-10)18-5-7-19(8-6-18)13(20)21-14(2,3)4/h9H,5-8H2,1-4H3
InChI key:InChIKey=DVSPFHLEILQZFS-UHFFFAOYSA-N
SMILES:CC1=CC(=NC(Cl)=N1)N2CCN(C(OC(C)(C)C)=O)CC2
Synonyms:
  • tert-Butyl 4-(2-chloro-6-methylpyrimidin-4-yl)piperazine-1-carboxylate
  • 1-Piperazinecarboxylic acid, 4-(2-chloro-6-methyl-4-pyrimidinyl)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-(2-chloro-6-methyl-4-pyrimidinyl)-1-piperazinecarboxylate
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