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Chemical structure of N-Methyl-N'-methyl-O-(m-PEG4)-O'-(azide-PEG4)-Cy3

GC67224

N-Methyl-N'-methyl-O-(m-PEG4)-O'-(azide-PEG4)-Cy3

Also known as 2-[(E,3E)-3-[5-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1,3,3-trimethylindol-2-ylidene]prop-1-enyl]-5-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1,3,3-trimethylindol-1-ium chloride

N-Methyl-N'-methyl-O-(m-PEG4)-O'-(azide-PEG4)-Cy3 is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs

ChemicalCAS2107273-64-1MW860.48FormulaC44H66ClN5O10
CAS number
2107273-64-1
Molecular weight
860.48
Formula
C44H66ClN5O10
InChIKey
FHRNKBLFTPHSBL-UHFFFAOYSA-M
Catalogue number
GC67224
Brand
GLPBIO
Computed properties PubChem CID 126480519 · TPSA 113 Ų · H-bond donors 0 · H-bond acceptors 14
TPSA
113 Ų
H-bond donors
0
H-bond acceptors
14
Rotatable bonds
31
Heavy atoms
60

SMILES CC1(C2=C(C=CC(=C2)OCCOCCOCCOCCOC)[N+](=C1/C=C/C=C/3\C(C4=C(N3C)C=CC(=C4)OCCOCCOCCOCCOCCN=[N+]=[N-])(C)C)C)C.[Cl-]

Computed descriptors from PubChem (CID 126480519), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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