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CAS 144927-57-1

:

7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester

Description:
7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester, identified by CAS number 144927-57-1, is a chemical compound that belongs to the class of pyrrolopyrimidines. This compound features a pyrrolopyrimidine core, which is characterized by a fused pyrrole and pyrimidine ring structure. The presence of a carboxylic acid group and an ethyl ester indicates that it has both acidic and ester functionalities, which can influence its reactivity and solubility. The 4-chloro substituent introduces a halogen atom, which can affect the compound's electronic properties and biological activity. Typically, such compounds may exhibit interesting pharmacological properties, making them of interest in medicinal chemistry. The structural features suggest potential applications in drug development, particularly in targeting specific biological pathways. Additionally, the compound's stability, solubility, and reactivity can be influenced by the presence of the chloro and ethyl groups, which may also affect its interactions with biological molecules.
Formula:C9H8ClN3O2
InChI:InChI=1S/C9H8ClN3O2/c1-2-15-9(14)5-3-11-8-6(5)7(10)12-4-13-8/h3-4H,2H2,1H3,(H,11,12,13)
InChI key:InChIKey=PCLIRPRTLSCXET-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C=2C(NC1)=NC=NC2Cl
Synonyms:
  • 1H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester
  • 7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester
  • Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
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