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Chemical structure of EED inhibitor-1

GC32909

EED inhibitor-1

Also known as N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2-methyl-3-pyridinyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine

EED inhibitor-1 is an embryonic ectoderm development (EED) inhibitor extracted from patent US20160176882 A1, compound example 2· EED inhibitor-1 exhibits IC50s of 59, 89, 26 nM in EED Alphascreen binding, LC-MS and ELISA assay

ChemicalCAS1951408-58-4MW376.39FormulaC20H17FN6O
CAS number
1951408-58-4
Molecular weight
376.39
Formula
C20H17FN6O
Solubility
DMSO : 52 mg/mL (138·15 mM);Water : < 0·1 mg/mL (insoluble)
InChIKey
XLIBABIFOBYHSV-UHFFFAOYSA-N
Catalogue number
GC32909
Brand
GLPBIO
Computed properties PubChem CID 121412508 · XLogP 3.4 · TPSA 77.2 Ų · H-bond donors 1
XLogP
3.4
TPSA
77.2 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
28

SMILES CC1=C(C=CC=N1)C2=CN=C(N3C2=NN=C3)NCC4=C(C=CC5=C4CCO5)F

Computed descriptors from PubChem (CID 121412508), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Pricing
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