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Chemical structure of Lenalidomide-propargyl-C2-NH2 hydrochloride

GC38808

Lenalidomide-propargyl-C2-NH2 hydrochloride

Also known as 3-[7-(5-aminopent-1-ynyl)-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione;hydrochloride

Lenalidomide-propargyl-C2-NH2 hydrochloride incorporates a cereblon (CRBN) ligand for the E3 ubiquitin ligase, and a linker· Lenalidomide-propargyl-C2-NH2 hydrochloride can be used to design the PROTAC MD-224

ChemicalCAS2489242-23-9MW361.82FormulaC18H20ClN3O3
CAS number
2489242-23-9
Molecular weight
361.82
Formula
C18H20ClN3O3
Solubility
Soluble in DMSO
InChIKey
QONOSTNDZFIDAF-UHFFFAOYSA-N
Catalogue number
GC38808
Brand
GLPBIO
Computed properties PubChem CID 145925671 · TPSA 92.5 Ų · H-bond donors 3 · H-bond acceptors 4
TPSA
92.5 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
25

SMILES C1CC(=O)NC(=O)C1N2CC3=C(C=CC=C3C2=O)C#CCCCN.Cl

Computed descriptors from PubChem (CID 145925671), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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