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Chemical structure of SR-1114

GC64920

SR-1114

Also known as N-cyclobutyl-2-[3-[2-[2-[2-[[2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetyl]amino]ethoxy]ethoxy]ethylsulfamoylamino]phenyl]imidazo[1,2-a]pyridine-6-carboxamide

SR-1114 is a first-in-class PROTAC ENL degrader· SR-1114 elicits rapid, CRBN-dependent degradation of ENL with DC50s of 150 nM, 311 nM, and 1·65 μM in MV4;11 , MOLM-13, and OCI/AML-2 cells, respectively

ChemicalCAS2769141-82-2MW830.86FormulaC39H42N8O11S
CAS number
2769141-82-2
Molecular weight
830.86
Formula
C39H42N8O11S
InChIKey
WPVVPCVQEBQVLL-UHFFFAOYSA-N
Catalogue number
GC64920
Brand
GLPBIO
Computed properties PubChem CID 155925846 · XLogP 1.2 · TPSA 253 Ų · H-bond donors 5
XLogP
1.2
TPSA
253 Ų
H-bond donors
5
H-bond acceptors
14
Rotatable bonds
19
Heavy atoms
59

SMILES C1CC(C1)NC(=O)C2=CN3C=C(N=C3C=C2)C4=CC(=CC=C4)NS(=O)(=O)NCCOCCOCCNC(=O)COC5=CC=CC6=C5C(=O)N(C6=O)C7CCC(=O)NC7=O

Computed descriptors from PubChem (CID 155925846), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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