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CAS 939986-76-2

:

1,1-Dimethylethyl 4-[(6-chloro-4-pyrimidinyl)amino]-1-piperidinecarboxylate

Description:
1,1-Dimethylethyl 4-[(6-chloro-4-pyrimidinyl)amino]-1-piperidinecarboxylate, identified by its CAS number 939986-76-2, is a chemical compound that features a piperidine ring, which is a six-membered nitrogen-containing heterocycle. This compound is characterized by the presence of a dimethyl group, which contributes to its steric bulk, and a chloro-substituted pyrimidine moiety that may enhance its biological activity. The carboxylate functional group indicates that it can participate in various chemical reactions, including esterification and amidation. Its structural complexity suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific biological pathways. The presence of halogen atoms, such as chlorine, often influences the compound's lipophilicity and reactivity, which can be critical for its efficacy and bioavailability. Overall, this compound's unique structural features make it a subject of interest for further research in drug development and related fields.
Formula:C14H21ClN4O2
InChI:InChI=1S/C14H21ClN4O2/c1-14(2,3)21-13(20)19-6-4-10(5-7-19)18-12-8-11(15)16-9-17-12/h8-10H,4-7H2,1-3H3,(H,16,17,18)
InChI key:InChIKey=XLZGMUJBIFJFDO-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CCC(NC=2C=C(Cl)N=CN2)CC1
Synonyms:
  • 1-Piperidinecarboxylic acid, 4-[(6-chloro-4-pyrimidinyl)amino]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-[(6-chloro-4-pyrimidinyl)amino]-1-piperidinecarboxylate
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