Cas no 1393525-02-4 (2-(Methylamino)-1,3-thiazole-5-carboxylic acid)

2-(Methylamino)-1,3-thiazole-5-carboxylic acid is a heterocyclic compound featuring a thiazole core substituted with a methylamino group at the 2-position and a carboxylic acid moiety at the 5-position. This structure imparts versatility in synthetic applications, particularly as a building block in pharmaceutical and agrochemical research. The presence of both amino and carboxyl functional groups allows for further derivatization, enabling the synthesis of amides, esters, and other derivatives. Its thiazole scaffold is notable for contributing to bioactivity in various compounds. The product is typically used in intermediate synthesis, offering a balance of reactivity and stability for controlled modifications. Proper handling and storage under anhydrous conditions are recommended to preserve its integrity.
2-(Methylamino)-1,3-thiazole-5-carboxylic acid structure
1393525-02-4 structure
Product Name:2-(Methylamino)-1,3-thiazole-5-carboxylic acid
CAS No:1393525-02-4
MF:C5H6N2O2S
MW:158.178339481354
CID:4593663
PubChem ID:57971496
Update Time:2025-10-29

2-(Methylamino)-1,3-thiazole-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(methylamino)-1,3-thiazole-5-carboxylic acid
    • 2-(methylamino)thiazole-5-carboxylic acid
    • STL301978
    • Z1416282602
    • 2-(Methylamino)-1,3-thiazole-5-carboxylic acid
    • Inchi: 1S/C5H6N2O2S/c1-6-5-7-2-3(10-5)4(8)9/h2H,1H3,(H,6,7)(H,8,9)
    • InChI Key: RHZXOWLIXHSMNO-UHFFFAOYSA-N
    • SMILES: S1C(C(=O)O)=CN=C1NC

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 142
  • XLogP3: 1.1
  • Topological Polar Surface Area: 90.5

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