Cas no 171179-73-0 (6-Benzothiazolecarboxamide,5-amino-)

6-Benzothiazolecarboxamide,5-amino- structure
171179-73-0 structure
Product Name:6-Benzothiazolecarboxamide,5-amino-
CAS No:171179-73-0
MF:C8H7N3OS
MW:193.225679636002
CID:111389
PubChem ID:18184425
Update Time:2025-04-18

6-Benzothiazolecarboxamide,5-amino- Chemical and Physical Properties

Names and Identifiers

    • 6-Benzothiazolecarboxamide,5-amino-
    • 6-Benzothiazolecarboxamide,5-amino-(9CI)
    • 171179-73-0
    • 5-aminobenzothiazole-6-carboxamide
    • REYLWTJXMPVPJM-UHFFFAOYSA-N
    • SCHEMBL7218081
    • 5-amino-1,3-benzothiazole-6-carboxamide
    • Inchi: 1S/C8H7N3OS/c9-5-2-6-7(13-3-11-6)1-4(5)8(10)12/h1-3H,9H2,(H2,10,12)
    • InChI Key: REYLWTJXMPVPJM-UHFFFAOYSA-N
    • SMILES: S1C=NC2C=C(C(C(N)=O)=CC1=2)N

Computed Properties

  • Exact Mass: 193.03098303g/mol
  • Monoisotopic Mass: 193.03098303g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 223
  • 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: 1.1
  • Topological Polar Surface Area: 110?2
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