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Chemical structure of Lenalidomide-I

GC62147

Lenalidomide-I

Also known as 3-(7-iodo-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione

Lenalidomide-I (Compound 72), an analog of cereblon (CRBN) ligand Lenalidomide for E3 ubiquitin ligase, is used in the recruitment of CRBN protein· Lenalidomide-I can be connected to the ligand for protein by a linker to form PROTACs, such as the PROTAC BET degrader QCA570

ChemicalCAS2207541-30-6MW370.14FormulaC13H11IN2O3
CAS number
2207541-30-6
Molecular weight
370.14
Formula
C13H11IN2O3
Solubility
DMSO ： 25 mg/mL (67·54 mM; Need ultrasonic)
InChIKey
BKIUJJLYXXEGFT-UHFFFAOYSA-N
Catalogue number
GC62147
Brand
GLPBIO
Computed properties PubChem CID 134348132 · XLogP 0.8 · TPSA 66.5 Ų · H-bond donors 1
XLogP
0.8
TPSA
66.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
19

SMILES C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=CC=C3I

Computed descriptors from PubChem (CID 134348132), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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