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Chemical structure of PDK4-IN-1 hydrochloride

GC39500

PDK4-IN-1 hydrochloride

Also known as 1-(1-piperidin-4-ylpyrazol-4-yl)anthracene-9,10-dione;hydrochloride

PDK4-IN-1 hydrochloride is an anthraquinone derivative and a potent and orally active pyruvate dehydrogenase kinase 4 (PDK4) inhibitor with an IC50 value of 84 nM

ChemicalCAS2310262-11-2MW393.87FormulaC22H20ClN3O2
CAS number
2310262-11-2
Molecular weight
393.87
Formula
C22H20ClN3O2
Solubility
DMSO： 125 mg/mL (317·36 mM)
InChIKey
ZIMLKZKPNALXKK-UHFFFAOYSA-N
Catalogue number
GC39500
Brand
GLPBIO
Computed properties PubChem CID 146026197 · TPSA 64 Ų · H-bond donors 2 · H-bond acceptors 4
TPSA
64 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
28

SMILES C1CNCCC1N2C=C(C=N2)C3=C4C(=CC=C3)C(=O)C5=CC=CC=C5C4=O.Cl

Computed descriptors from PubChem (CID 146026197), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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