Description

5-Iodo-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one (CAS No. 135352-71-5) is a high-purity heterocyclic compound with the molecular formula C₆H₄IN₃O. This iodinated pyrrolopyrimidine derivative is a valuable intermediate in organic synthesis and pharmaceutical research, particularly in the development of nucleoside analogs and kinase inhibitors. Its unique structure, featuring a fused pyrrole-pyrimidine core with an iodine substituent, makes it a versatile building block for medicinal chemistry and drug discovery applications.

Our product is rigorously tested to ensure exceptional quality, with purity levels exceeding 98% (HPLC). It is supplied as a crystalline solid with detailed characterization data including ¹H NMR, ¹³C NMR, and mass spectrometry for verification. Proper storage at 2-8°C under inert atmosphere is recommended to maintain stability.

Properties

• CAS Number: 135352-71-5
• Complexity: 218
• IUPAC Name: 5-iodo-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
• InChI: InChI=1S/C6H4IN3O/c7-3-1-8-5-4(3)6(11)10-2-9-5/h1-2H,(H2,8,9,10,11)
• InChI Key: QHYIUMOXLCMESH-UHFFFAOYSA-N
• Exact Mass: 260.93991
• Molecular Formula: C6H4IN3O
• Molecular Weight: 261.02
• SMILES: C1=C(C2=C(N1)N=CNC2=O)I
• Topological: 57.3
• Monoisotopic Mass: 260.93991
• Synonyms: 135352-71-5, 5-Iodo-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one, 5-IODO-3H-PYRROLO[2,3-D]PYRIMIDIN-4(7H)-ONE, 5-iodo-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one, 3,7-DIHYDRO-5-IODO-4-OXO-4H-PYRROLO[2,3-D]PYRIMIDINE, 5-Iodo-3,7-dihydro-pyrrolo[2,3-d]pyrimidin-4-one, MFCD09746273, C6H4IN3O, 5-iodo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one, SCHEMBL7887899, SCHEMBL7887902, 3,7-Dihydro-5-iodo-4H-pyrrolo[2,3-d]pyrimidin-4-one, SCHEMBL15519347, DTXSID20447357, QHYIUMOXLCMESH-UHFFFAOYSA-N, AKOS016003783, ND57427, PS-3937, BL002782, SY041740, DB-349999, 4-hydroxy- 5-iodopyrrolo[2,3-d]pyrimidine, CS-0041346, A927712, 5-Iodo-3,7-dihydro-pyrrolo[2,3-?]pyrimidin-4-one, 5-Iodo-1,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one

Application

5-Iodo-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one serves as a key precursor in the synthesis of modified nucleosides with potential antiviral and anticancer activity. Researchers utilize this compound to develop ATP-competitive kinase inhibitors targeting various disease pathways. Its iodine moiety enables further functionalization via cross-coupling reactions (e.g., Suzuki, Sonogashira) for structure-activity relationship studies in drug discovery programs.

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