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Chemical structure of DBCO-PEG5-NHS ester

GC66196

DBCO-PEG5-NHS ester

Also known as (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[2-[[4-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-4-oxobutanoyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate

DBCO-PEG5-NHS ester is a PEG/Alkyl/ether-based PROTAC linker can be used in the synthesis of PROTACs· DBCO-PEG5-NHS ester is a cleavable ADC linker used in the synthesis of antibody-drug conjugates (ADCs)

ChemicalCAS2144395-59-3MW693.74FormulaC36H43N3O11
CAS number
2144395-59-3
Molecular weight
693.74
Formula
C36H43N3O11
Solubility
DMSO : ≥ 100 mg/mL (144·15 mM)
InChIKey
OYNJSALGAVUYGZ-UHFFFAOYSA-N
Catalogue number
GC66196
Brand
GLPBIO
Computed properties PubChem CID 134159305 · XLogP 0.3 · TPSA 159 Ų · H-bond donors 1
XLogP
0.3
TPSA
159 Ų
H-bond donors
1
H-bond acceptors
11
Rotatable bonds
23
Heavy atoms
50

SMILES C1CC(=O)N(C1=O)OC(=O)CCOCCOCCOCCOCCOCCNC(=O)CCC(=O)N2CC3=CC=CC=C3C#CC4=CC=CC=C42

Computed descriptors from PubChem (CID 134159305), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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