Cas no 1260860-78-3 (Ethyl 2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate)

Ethyl 2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate is a heterocyclic compound featuring a pyrrolo[2,3-d]pyrimidine core, functionalized with an amino group at the 2-position, a chloro substituent at the 4-position, and an ethyl ester at the 6-position. This structure makes it a versatile intermediate in medicinal chemistry, particularly for the synthesis of purine-like analogs and kinase inhibitors. The chloro and ester groups enhance reactivity, facilitating further derivatization, while the amino group provides a handle for selective modifications. Its well-defined reactivity profile and stability under standard conditions make it suitable for use in pharmaceutical research and the development of biologically active molecules.
Ethyl 2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate structure
1260860-78-3 structure
Product Name:Ethyl 2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate
CAS No:1260860-78-3
MF:C9H9ClN4O2
MW:240.64636015892
CID:1081966
PubChem ID:71748562
Update Time:2025-06-07

Ethyl 2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate
    • DB-351380
    • DTXSID40857656
    • ZB0441
    • Ethyl2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate
    • 1260860-78-3
    • MDL: MFCD13195429
    • Inchi: 1S/C9H9ClN4O2/c1-2-16-8(15)5-3-4-6(10)13-9(11)14-7(4)12-5/h3H,2H2,1H3,(H3,11,12,13,14)
    • InChI Key: ZESHWVWQUFLVCL-UHFFFAOYSA-N
    • SMILES: ClC1=C2C=C(C(=O)OCC)NC2=NC(N)=N1

Computed Properties

  • Exact Mass: 240.0414032g/mol
  • Monoisotopic Mass: 240.0414032g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 278
  • 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: 1.8
  • Topological Polar Surface Area: 93.9?2

Ethyl 2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate Pricemore >>

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