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Thalidomide-O-amido-PEG4-C2-NH2 hydrochloride - CAS 2245697-85-0

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Thalidomide-O-amido-PEG4-C2-NH2 hydrochloride is a synthetic E3 ligand-linker conjugate containing a cereblon ligand based on Thalidomide and a PEG linker of 4 O(CH2)2 units with terminal amine, as a part of a variety of functionalized PROTAC molecules for binding to a target protein ligand.

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Molecular Formula

C₂₅H₃₅ClN₄O₁₀

Molecular Weight

587.02

Thalidomide-O-amido-PEG4-C2-NH2 hydrochloride

- Specification
  - Storage
    
    Store at -20°C
    
    Shipping
    
    Room temperature in continental US; may vary elsewhere.
    
    IUPAC Name
    
    N-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethyl]-2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetamide;hydrochloride
    
    Synonyms
    
    Thalidomide - linker 2
- Properties
  - InChI Key
    
    YHQOQBFOLKFJJN-UHFFFAOYSA-N
    
    InChI
    
    1S/C25H34N4O10.ClH/c26-6-8-35-10-12-37-14-15-38-13-11-36-9-7-27-21(31)16-39-19-3-1-2-17-22(19)25(34)29(24(17)33)18-4-5-20(30)28-23(18)32;/h1-3,18H,4-16,26H2,(H,27,31)(H,28,30,32);1H
    
    Canonical SMILES
    
    O=C(C1=C(C(OCC(NCCOCCOCCOCCOCCN)=O)=CC=C1)C2=O)N2C(C(N3)=O)CCC3=O.Cl
    
    Pub Chem ID
    
    134160247

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