Cas no 852388-96-6 (4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine)

4-(2-Chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine is a thiazole-based compound featuring a 2-chlorophenyl substituent at the 4-position and a (4-fluorophenyl)methylamino group at the 2-position. This structure imparts unique electronic and steric properties, making it a valuable intermediate in pharmaceutical and agrochemical research. The presence of both chloro and fluoro substituents enhances its potential for selective binding interactions, particularly in the development of bioactive molecules. Its well-defined heterocyclic core offers stability and versatility for further functionalization. The compound is typically characterized by high purity and consistent performance, ensuring reliability in synthetic applications. Researchers may explore its utility in kinase inhibition or as a scaffold for novel therapeutic agents.
4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine structure
852388-96-6 structure
Product Name:4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine
CAS No:852388-96-6
MF:C16H12ClFN2S
MW:318.796284675598
CID:3108066
PubChem ID:2560513
Update Time:2025-06-13

4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine Chemical and Physical Properties

Names and Identifiers

    • 4-(2-chlorophenyl)-N-(4-fluorobenzyl)-1,3-thiazol-2-amine
    • 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine
    • G30362
    • C16H12ClFN2S
    • CS-0232441
    • CJB38896
    • Z85934853
    • 852388-96-6
    • 4-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]-1,3-thiazol-2-amine
    • EN300-12723
    • AKOS034637462
    • Inchi: 1S/C16H12ClFN2S/c17-14-4-2-1-3-13(14)15-10-21-16(20-15)19-9-11-5-7-12(18)8-6-11/h1-8,10H,9H2,(H,19,20)
    • InChI Key: VOCANBCVEVWLLO-UHFFFAOYSA-N
    • SMILES: ClC1C=CC=CC=1C1=CSC(=N1)NCC1C=CC(=CC=1)F

Computed Properties

  • Exact Mass: 318.0393754Da
  • Monoisotopic Mass: 318.0393754Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 325
  • 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: 5.2
  • Topological Polar Surface Area: 53.2?2

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Additional information on 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine

Recent Advances in the Study of 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine (CAS: 852388-96-6)

The compound 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine (CAS: 852388-96-6) has recently garnered significant attention in the field of chemical biology and pharmaceutical research. This thiazole derivative, characterized by its unique structural features, has shown promising potential in various therapeutic applications. Recent studies have focused on elucidating its mechanism of action, pharmacokinetic properties, and therapeutic efficacy, making it a compound of considerable interest for drug development.

One of the key areas of research has been the compound's interaction with specific biological targets. Preliminary findings suggest that 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine exhibits selective binding affinity towards certain kinase enzymes, which are implicated in a range of pathological conditions, including cancer and inflammatory diseases. This selectivity is attributed to the compound's ability to form stable interactions with the ATP-binding sites of these kinases, thereby modulating their activity.

In vitro and in vivo studies have further demonstrated the compound's potential as a therapeutic agent. For instance, recent experiments conducted on cell lines have shown that 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine can inhibit the proliferation of cancer cells by inducing apoptosis and cell cycle arrest. These effects were observed at micromolar concentrations, indicating its potency. Additionally, animal studies have revealed favorable pharmacokinetic profiles, including good oral bioavailability and moderate half-life, which are critical for its development as a drug candidate.

Another noteworthy aspect of this compound is its synthetic accessibility. Researchers have developed efficient synthetic routes to produce 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine with high yields and purity. These methods often involve multi-step reactions, including the formation of the thiazole ring and subsequent functionalization. The scalability of these synthetic procedures is a significant advantage for large-scale production, which is essential for further preclinical and clinical studies.

Despite these promising findings, challenges remain in the development of 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine as a therapeutic agent. Issues such as potential off-target effects, metabolic stability, and toxicity profiles need to be thoroughly investigated. Ongoing research is focused on optimizing the compound's structure to enhance its selectivity and reduce adverse effects. Computational modeling and structure-activity relationship (SAR) studies are being employed to guide these modifications.

In conclusion, 4-(2-chlorophenyl)-N-(4-fluorophenyl)methyl-1,3-thiazol-2-amine (CAS: 852388-96-6) represents a promising candidate for further drug development. Its unique chemical structure, combined with its demonstrated biological activity, makes it a valuable subject of study in the field of chemical biology and pharmaceutical research. Future studies will likely focus on advancing this compound through the drug development pipeline, with the ultimate goal of translating these findings into clinically viable therapies.

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