Description

Ethyl 4-(cyclopentylamino)-2-(methylsulfanyl)pyrimidine-5-carboxylate (CAS No. 211245-62-4) is a high-purity pyrimidine derivative designed for advanced research and pharmaceutical applications. This compound, with the molecular formula C₁₃H₁₉N₃O₂S and IUPAC name ethyl 4-(cyclopentylamino)-2-methylsulfanylpyrimidine-5-carboxylate, features a cyclopentylamino group and a methylsulfanyl substituent, making it a versatile intermediate in medicinal chemistry and drug discovery. Its precise synthesis and characterization ensure optimal performance in heterocyclic compound studies, kinase inhibitor development, and structure-activity relationship (SAR) investigations. Available in quantities from milligrams to grams, this product is rigorously tested for purity (typically ≥95% by HPLC) and stability, meeting the stringent demands of academic and industrial researchers.

Properties

• CAS Number: 211245-62-4
• Complexity: 298
• IUPAC Name: ethyl 4-(cyclopentylamino)-2-methylsulfanyl-pyrimidine-5-carboxylate
• InChI: InChI=1S/C13H19N3O2S/c1-3-18-12(17)10-8-14-13(19-2)16-11(10)15-9-6-4-5-7-9/h8-9H,3-7H2,1-2H3,(H,14,15,16)
• InChI Key: MYJQMHHJSZBXNK-UHFFFAOYSA-N
• Exact Mass: 281.11979803
• Molecular Formula: C13H19N3O2S
• Molecular Weight: 281.38
• SMILES: CCOC(=O)C1=CN=C(N=C1NC2CCCC2)SC
• Topological: 89.4
• Monoisotopic Mass: 281.11979803
• Synonyms: 211245-62-4, ETHYL 4-(CYCLOPENTYLAMINO)-2-(METHYLSULFANYL)PYRIMIDINE-5-CARBOXYLATE, DTXSID90429347, DTXCID90380181, ethyl 4-(cyclopentylamino)-2-(methylthio)pyrimidine-5-carboxylate, 4-(cyclopentylamino)-2-(methylthio)-5-Pyrimidinecarboxylic acid ethyl ester, ethyl 4-(cyclopentylamino)-2-methylsulfanylpyrimidine-5-carboxylate, 5-Pyrimidinecarboxylic acid, 4-(cyclopentylamino)-2-(methylthio)-, ethyl ester, 4-cyclopentylaMino-2-Methylsulfanylpyrimidine-5-carboxylic acid ethyl ester, MFCD09833994, SCHEMBL574167, CHEMBL4750434, MYJQMHHJSZBXNK-UHFFFAOYSA-N, ethyl 4-(cyclopentylamino)-2-methylsulfanyl-pyrimidine-5-carboxylate, GEO-04295, AKOS022175384, SB59422, AC-31682, AS-73556, PD129739, DB-066432, CS-0449528, W10684, ethyl-(cyclopentylamino)-2-(methylthio)pyrimidine-5-carboxylate, ethyl4-(cyclopentylamino)-2-(methylthio)pyrimidine-5-carboxylate, 4-Cyclopentylamino-2-methanethiopyrimidine-5-carboxylic acid ethyl ester, 4-Cyclopentylamino-2-methylsulfanyl-pyrimidine-5-carboxylic acid ethyl ester

Application

Ethyl 4-(cyclopentylamino)-2-(methylsulfanyl)pyrimidine-5-carboxylate serves as a key building block in the synthesis of bioactive pyrimidine scaffolds, particularly in kinase inhibitor design. Its structural motifs are valuable for probing enzyme-substrate interactions in cancer research and inflammatory disease models. Researchers utilize this compound to explore modifications at the 2- and 4-positions of the pyrimidine core for optimizing drug-like properties.

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