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CAS 1017782-56-7

:

1,1-Dimethylethyl 4-[6-chloro-5-(hydroxymethyl)-4-pyrimidinyl]-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl 4-[6-chloro-5-(hydroxymethyl)-4-pyrimidinyl]-1-piperazinecarboxylate, identified by its CAS number 1017782-56-7, is a chemical compound that features a complex structure incorporating a piperazine moiety and a pyrimidine ring. This compound is characterized by the presence of a dimethyl group, which contributes to its steric properties, and a chloro substituent that may influence its reactivity and biological activity. The hydroxymethyl group on the pyrimidine ring can participate in hydrogen bonding, potentially enhancing its solubility and interaction with biological targets. The carboxylate functional group is likely to play a significant role in the compound's acid-base behavior and its ability to form salts. Overall, this compound may exhibit interesting pharmacological properties, making it a candidate for further research in medicinal chemistry, particularly in the development of therapeutic agents. Its specific characteristics, such as solubility, stability, and reactivity, would depend on the surrounding conditions and the presence of other functional groups.
Formula:C14H21ClN4O3
InChI:InChI=1S/C14H21ClN4O3/c1-14(2,3)22-13(21)19-6-4-18(5-7-19)12-10(8-20)11(15)16-9-17-12/h9,20H,4-8H2,1-3H3
InChI key:InChIKey=IFMZXONHGLMRMM-UHFFFAOYSA-N
SMILES:C(O)C=1C(=NC=NC1Cl)N2CCN(C(OC(C)(C)C)=O)CC2
Synonyms:
  • 1-Piperazinecarboxylic acid, 4-[6-chloro-5-(hydroxymethyl)-4-pyrimidinyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-[6-chloro-5-(hydroxymethyl)-4-pyrimidinyl]-1-piperazinecarboxylate
  • tert-butyl 4-[6-chloro-5-(hydroxymethyl)-4-pyrimidinyl]tetrahydro-1(2H)-pyrazinecarboxylate
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