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CAS 1146629-75-5

:

(4-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl 2,2-dimethylpropanoate

Description:
The chemical substance known as (4-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl 2,2-dimethylpropanoate, with the CAS number 1146629-75-5, is a synthetic organic compound that features a pyrrolopyrimidine core structure. This compound is characterized by the presence of a chloro substituent at the 4-position of the pyrrolopyrimidine ring, which can influence its reactivity and biological activity. The ester functional group, derived from 2,2-dimethylpropanoic acid, suggests potential applications in medicinal chemistry, particularly in drug design, due to its ability to modify pharmacokinetic properties. The presence of the bulky 2,2-dimethylpropanoate moiety may enhance lipophilicity, potentially improving membrane permeability. Additionally, the compound's structural features may confer specific interactions with biological targets, making it of interest in the development of therapeutic agents. Overall, this compound exemplifies the complexity and diversity of synthetic organic molecules used in various chemical and pharmaceutical applications.
Formula:C12H14ClN3O2
InChI:InChI=1S/C12H14ClN3O2/c1-12(2,3)11(17)18-7-16-5-4-8-9(13)14-6-15-10(8)16/h4-6H,7H2,1-3H3
InChI key:InChIKey=DTPDTZKIIYSQPO-UHFFFAOYSA-N
SMILES:C(OC(C(C)(C)C)=O)N1C=2C(C=C1)=C(Cl)N=CN2
Synonyms:
  • (4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl pivalate
  • Propanoic acid, 2,2-dimethyl-, (4-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl ester
  • (4-Chloro-7h-pyrrolo[2,3-d]pyrimidin-7-yl)metethyl pivlateala
  • (4-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl 2,2-dimethylpropanoate
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