Cas no 90770-58-4 (4-hexyl-1,3-thiazol-2-amine)

4-Hexyl-1,3-thiazol-2-amine is a thiazole derivative featuring a hexyl substituent at the 4-position and an amine group at the 2-position. This compound is of interest in organic synthesis and pharmaceutical research due to its structural versatility as a heterocyclic scaffold. The hexyl chain enhances lipophilicity, potentially improving membrane permeability in bioactive applications. Its amine functionality allows for further derivatization, making it a valuable intermediate in the development of pharmacologically active molecules. The thiazole core contributes to its stability and potential biological activity, often explored in antimicrobial and anti-inflammatory agents. Suitable for controlled reactions, it is typically handled under inert conditions to preserve reactivity.
4-hexyl-1,3-thiazol-2-amine structure
4-hexyl-1,3-thiazol-2-amine structure
Product Name:4-hexyl-1,3-thiazol-2-amine
CAS No:90770-58-4
MF:C9H16N2S
MW:184.301740646362
CID:1954180
PubChem ID:13934262
Update Time:2025-05-19

4-hexyl-1,3-thiazol-2-amine Chemical and Physical Properties

Names and Identifiers

    • 4-hexyl-1,3-thiazol-2-amine
    • 4-hexylthiazol-2-amine
    • SCHEMBL3828155
    • DTXCID90503636
    • 90770-58-4
    • DB-367819
    • EN300-782043
    • 2-amino-4-hexylthiazole
    • DTXSID60552853
    • WEIHTWYIJMCQOT-UHFFFAOYSA-N
    • Inchi: 1S/C9H16N2S/c1-2-3-4-5-6-8-7-12-9(10)11-8/h7H,2-6H2,1H3,(H2,10,11)
    • InChI Key: WEIHTWYIJMCQOT-UHFFFAOYSA-N
    • SMILES: S1C(N)=NC(=C1)CCCCCC

Computed Properties

  • Exact Mass: 184.10341969Da
  • Monoisotopic Mass: 184.10341969Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 5
  • Complexity: 119
  • 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: 3.4
  • Topological Polar Surface Area: 67.2?2

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Additional information on 4-hexyl-1,3-thiazol-2-amine

4-Hexyl-1,3-thiazol-2-amine (CAS No. 90770-58-4): A Comprehensive Overview of Its Properties and Applications

The compound 4-hexyl-1,3-thiazol-2-amine (CAS No. 90770-58-4) is a specialized organic molecule belonging to the thiazole family, a class of heterocyclic compounds known for their diverse applications in pharmaceuticals, agrochemicals, and material science. With the increasing demand for novel bioactive molecules, 4-hexyl-1,3-thiazol-2-amine has garnered attention due to its unique structural features and potential utility in various industries. This article delves into its chemical properties, synthesis methods, and emerging applications, while addressing common queries and trends in scientific research.

Chemically, 4-hexyl-1,3-thiazol-2-amine consists of a thiazole ring—a five-membered structure containing sulfur and nitrogen atoms—substituted with a hexyl group at the 4-position and an amino group at the 2-position. This configuration imparts distinct electronic and steric properties, making it a valuable intermediate in organic synthesis. Researchers often explore its reactivity in cross-coupling reactions and heterocyclic functionalization, topics frequently searched in academic databases. The compound’s lipophilic nature, attributed to the hexyl chain, also enhances its compatibility with hydrophobic environments, a feature relevant to drug design and formulation.

In the pharmaceutical sector, thiazole derivatives like 4-hexyl-1,3-thiazol-2-amine are investigated for their bioactive potential. Recent studies highlight their role as enzyme inhibitors or receptor modulators, aligning with the growing interest in targeted therapies. For instance, thiazole-containing compounds have been explored for antimicrobial and anti-inflammatory activities, addressing global health concerns such as antibiotic resistance. While 90770-58-4 itself is not a drug, its structural motifs are valuable in medicinal chemistry, a point often emphasized in drug discovery forums.

Beyond pharmaceuticals, 4-hexyl-1,3-thiazol-2-amine finds utility in material science. Its conjugated system and electron-rich nature make it a candidate for designing organic semiconductors or fluorescent probes. These applications resonate with the surge in searches for sustainable materials and green chemistry solutions. Additionally, agrochemical researchers evaluate similar thiazoles for crop protection, leveraging their ability to interact with biological targets in pests.

Synthesis of 4-hexyl-1,3-thiazol-2-amine typically involves cyclization reactions of thioureas or Hantzsch thiazole synthesis, a well-documented method in organic chemistry literature. Optimizing yield and purity remains a focus, as reflected in queries about scalable synthesis and reaction conditions. Analytical techniques like NMR and HPLC are crucial for characterizing this compound, ensuring compliance with industry standards.

From an SEO perspective, terms like "thiazole amine applications", "CAS 90770-58-4 uses", and "hexyl thiazole synthesis" are frequently searched, underscoring the need for authoritative content. By integrating these keywords naturally, this article aims to bridge informational gaps while maintaining scientific rigor. As research progresses, 4-hexyl-1,3-thiazol-2-amine may unlock further innovations, solidifying its place in interdisciplinary science.

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