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CAS 1353977-99-7

:

1,1-Dimethylethyl 4-[6-(diethylamino)-4-pyrimidinyl]-2-methyl-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl 4-[6-(diethylamino)-4-pyrimidinyl]-2-methyl-1-piperazinecarboxylate, identified by its CAS number 1353977-99-7, is a chemical compound that belongs to the class of piperazine derivatives. This substance features a piperazine ring, which is a six-membered cyclic amine, and is substituted with a carboxylate group, contributing to its potential biological activity. The presence of a pyrimidine moiety, specifically a 4-(diethylamino) substitution, suggests that it may exhibit pharmacological properties, possibly acting as a ligand for various biological targets. The dimethyl and ethyl groups enhance its lipophilicity, which can influence its absorption and distribution in biological systems. Additionally, the compound's structure indicates potential for interactions with receptors or enzymes, making it of interest in medicinal chemistry. However, specific properties such as solubility, stability, and reactivity would require empirical data for comprehensive characterization. Overall, this compound represents a complex molecular architecture that may have implications in drug development and therapeutic applications.
Formula:C18H31N5O2
InChI:InChI=1S/C18H31N5O2/c1-7-21(8-2)15-11-16(20-13-19-15)22-9-10-23(14(3)12-22)17(24)25-18(4,5)6/h11,13-14H,7-10,12H2,1-6H3
InChI key:InChIKey=KWPUVEIHGVCQNG-UHFFFAOYSA-N
SMILES:N(CC)(CC)C1=CC(=NC=N1)N2CC(C)N(C(OC(C)(C)C)=O)CC2
Synonyms:
  • 1,1-Dimethylethyl 4-[6-(diethylamino)-4-pyrimidinyl]-2-methyl-1-piperazinecarboxylate
  • 1-Piperazinecarboxylic acid, 4-[6-(diethylamino)-4-pyrimidinyl]-2-methyl-, 1,1-dimethylethyl ester
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