Cas no 1007873-59-7 (2-Methyl-4-(3-fluoro-phenyl)-thiazole-5-carboxylic acid)

2-Methyl-4-(3-fluoro-phenyl)-thiazole-5-carboxylic acid is a fluorinated thiazole derivative with notable applications in pharmaceutical and agrochemical research. Its structural features, including the fluorine-substituted phenyl ring and carboxylic acid functionality, enhance its potential as a versatile intermediate in drug discovery, particularly for designing bioactive molecules with improved metabolic stability and binding affinity. The thiazole core contributes to its role as a scaffold in heterocyclic chemistry, while the methyl group at the 2-position may influence steric and electronic properties. This compound is valued for its synthetic utility in developing targeted inhibitors or ligands, making it a useful building block in medicinal chemistry and material science applications.
2-Methyl-4-(3-fluoro-phenyl)-thiazole-5-carboxylic acid structure
1007873-59-7 structure
Product Name:2-Methyl-4-(3-fluoro-phenyl)-thiazole-5-carboxylic acid
CAS No:1007873-59-7
MF:C11H8FNO2S
MW:237.250124931335
MDL:MFCD11221421
CID:2151539
Update Time:2025-06-09

2-Methyl-4-(3-fluoro-phenyl)-thiazole-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-4-(3-fluoro-phenyl)-thiazole-5-carboxylic acid
    • SHCIIJRDGAXAMV-UHFFFAOYSA-N
    • 4-(3-Fluorophenyl)-2-methylthiazole-5-carboxylic acid
    • 4-(3-fluoro-phenyl)-2-methyl-thiazole-5-carboxylic acid
    • 2-Methyl-4-(3-fluoro-phenyl)-thiazole-5-carboxylic acid
    • MDL: MFCD11221421
    • Inchi: 1S/C11H8FNO2S/c1-6-13-9(10(16-6)11(14)15)7-3-2-4-8(12)5-7/h2-5H,1H3,(H,14,15)
    • InChI Key: SHCIIJRDGAXAMV-UHFFFAOYSA-N
    • SMILES: S1C(C)=NC(=C1C(=O)O)C1C=CC=C(C=1)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 277
  • Topological Polar Surface Area: 78.4

2-Methyl-4-(3-fluoro-phenyl)-thiazole-5-carboxylic acid Pricemore >>

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