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Chemical structure of Thalidomide-NH-PEG8-Ts

GC67506

Thalidomide-NH-PEG8-Ts

Also known as 2-[2-[2-[2-[2-[2-[2-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate

Thalidomide-NH-PEG8-Ts is a synthesized E3 ligase ligand-linker conjugate that incorporates the Thalidomide based cereblon ligand and 8-unit PEG linker used in PROTAC technology, such as IDO1 PROTAC degrader

ChemicalCAS2488761-07-3MW779.85FormulaC36H49N3O14S
CAS number
2488761-07-3
Molecular weight
779.85
Formula
C36H49N3O14S
InChIKey
GZOHJVDFMQTYJD-UHFFFAOYSA-N
Catalogue number
GC67506
Brand
GLPBIO
Computed properties PubChem CID 162482363 · XLogP 1 · TPSA 212 Ų · H-bond donors 2
XLogP
1
TPSA
212 Ų
H-bond donors
2
H-bond acceptors
15
Rotatable bonds
28
Heavy atoms
54

SMILES CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOCCOCCOCCOCCOCCNC2=CC=CC3=C2C(=O)N(C3=O)C4CCC(=O)NC4=O

Computed descriptors from PubChem (CID 162482363), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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