Cas no 2248361-09-1 (Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate)

Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate is a versatile heterocyclic compound featuring an oxazole core substituted with a methylamino group at the 2-position and a tert-butoxycarbonyl moiety at the 5-position. This structure makes it a valuable intermediate in organic synthesis, particularly for the development of pharmaceuticals and agrochemicals. The tert-butyl ester group enhances stability and facilitates further functionalization under mild conditions. Its oxazole scaffold is notable for contributing to bioactive molecule design, offering potential applications in medicinal chemistry. The compound’s well-defined reactivity and compatibility with diverse reaction conditions underscore its utility in constructing complex molecular architectures.
Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate structure
2248361-09-1 structure
Product Name:Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate
CAS No:2248361-09-1
MF:C9H14N2O3
MW:198.219062328339
CID:5975608
PubChem ID:137937711
Update Time:2025-05-20

Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate
    • EN300-6510913
    • 2248361-09-1
    • Inchi: 1S/C9H14N2O3/c1-9(2,3)14-7(12)6-5-11-8(10-4)13-6/h5H,1-4H3,(H,10,11)
    • InChI Key: KFRRHHMSZAUOTR-UHFFFAOYSA-N
    • SMILES: O(C(C1=CN=C(NC)O1)=O)C(C)(C)C

Computed Properties

  • Exact Mass: 198.10044231g/mol
  • Monoisotopic Mass: 198.10044231g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 213
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 64.4?2

Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate Pricemore >>

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Additional information on Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate

Recent Advances in the Application of Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate (CAS: 2248361-09-1) in Chemical Biology and Pharmaceutical Research

Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate (CAS: 2248361-09-1) is a key intermediate in the synthesis of biologically active compounds, particularly in the development of novel pharmaceuticals targeting various diseases. Recent studies have highlighted its significance in medicinal chemistry due to its versatile reactivity and potential as a building block for drug discovery. This research briefing aims to provide an overview of the latest advancements involving this compound, focusing on its applications, synthetic methodologies, and biological activities.

In a recent study published in the Journal of Medicinal Chemistry, researchers explored the use of Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate as a precursor for the synthesis of small-molecule inhibitors targeting protein kinases. The study demonstrated that derivatives of this compound exhibited potent inhibitory activity against specific kinases involved in cancer progression, suggesting its potential as a scaffold for anticancer drug development. The researchers employed a combination of computational modeling and experimental validation to optimize the compound's structure for enhanced binding affinity and selectivity.

Another significant development was reported in a 2023 article in Bioorganic & Medicinal Chemistry Letters, where the compound was utilized in the synthesis of novel antimicrobial agents. The study revealed that modifications to the oxazole ring of Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate resulted in derivatives with broad-spectrum activity against drug-resistant bacterial strains. These findings underscore the compound's utility in addressing the growing challenge of antimicrobial resistance, a critical issue in global health.

Furthermore, recent advancements in synthetic methodologies have improved the efficiency of producing Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate. A study in Organic Process Research & Development detailed a scalable and environmentally friendly synthesis route, reducing the reliance on hazardous reagents and minimizing waste generation. This progress is particularly relevant for industrial-scale production, ensuring the compound's availability for further pharmaceutical applications.

In conclusion, Tert-butyl 2-(methylamino)-1,3-oxazole-5-carboxylate (CAS: 2248361-09-1) continues to be a valuable tool in chemical biology and pharmaceutical research. Its applications in kinase inhibition, antimicrobial development, and scalable synthesis highlight its versatility and potential for future drug discovery efforts. Ongoing research is expected to uncover additional therapeutic opportunities, further solidifying its role in the field.

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