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CAS 1133115-56-6

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Methyl 2-amino-4-(4-chlorophenyl)-5-pyrimidinecarboxylate

Description:
Methyl 2-amino-4-(4-chlorophenyl)-5-pyrimidinecarboxylate is a chemical compound characterized by its pyrimidine core, which is a six-membered heterocyclic ring containing nitrogen atoms. This compound features a methyl ester functional group, contributing to its solubility and reactivity. The presence of an amino group enhances its potential for forming hydrogen bonds, which can influence its biological activity and interactions with other molecules. The 4-chlorophenyl substituent introduces a chlorine atom, which can affect the compound's electronic properties and lipophilicity, potentially impacting its pharmacological profile. This compound may be of interest in medicinal chemistry, particularly in the development of pharmaceuticals, due to its structural features that could interact with biological targets. Additionally, its synthesis and characterization would typically involve standard organic chemistry techniques, including purification methods such as recrystallization or chromatography. Overall, Methyl 2-amino-4-(4-chlorophenyl)-5-pyrimidinecarboxylate represents a versatile scaffold for further chemical modifications and applications in various fields, including drug discovery and agrochemicals.
Formula:C12H10ClN3O2
InChI:InChI=1S/C12H10ClN3O2/c1-18-11(17)9-6-15-12(14)16-10(9)7-2-4-8(13)5-3-7/h2-6H,1H3,(H2,14,15,16)
InChI key:InChIKey=ZTGNMIAZPDWDRW-UHFFFAOYSA-N
SMILES:C(OC)(=O)C=1C(=NC(N)=NC1)C2=CC=C(Cl)C=C2
Synonyms:
  • 5-Pyrimidinecarboxylic acid, 2-amino-4-(4-chlorophenyl)-, methyl ester
  • Methyl 2-amino-4-(4-chlorophenyl)-5-pyrimidinecarboxylate
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