Cas no 1936669-45-2 (5-Bromo-2,4-dichloro-6-methyl-7H-pyrrolo[2,3-d]pyrimidine)

5-Bromo-2,4-dichloro-6-methyl-7H-pyrrolo[2,3-d]pyrimidine structure
1936669-45-2 structure
Product Name:5-Bromo-2,4-dichloro-6-methyl-7H-pyrrolo[2,3-d]pyrimidine
CAS No:1936669-45-2
MF:C7H4BrCl2N3
MW:280.936758041382
CID:6941552
PubChem ID:130115330
Update Time:2025-05-08

5-Bromo-2,4-dichloro-6-methyl-7H-pyrrolo[2,3-d]pyrimidine Chemical and Physical Properties

Names and Identifiers

    • 1936669-45-2
    • 5-Bromo-2,4-dichloro-6-methyl-7H-pyrrolo[2,3-d]pyrimidine
    • Inchi: 1S/C7H4BrCl2N3/c1-2-4(8)3-5(9)12-7(10)13-6(3)11-2/h1H3,(H,11,12,13)
    • InChI Key: MADOEZPZHMKOBR-UHFFFAOYSA-N
    • SMILES: BrC1=C(C)NC2C1=C(N=C(N=2)Cl)Cl

Computed Properties

  • Exact Mass: 278.89657Da
  • Monoisotopic Mass: 278.89657Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 206
  • 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: 3.7
  • Topological Polar Surface Area: 41.6?2
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