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Chemical structure of Xanthine amine congener hydrochloride

GC64546

Xanthine amine congener hydrochloride

Also known as N-(2-aminoethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxy]acetamide;hydrochloride

Xanthine amine congener (XAC) hydrochloride is a non-selective adenosine receptor antagonist

ChemicalCAS1783977-95-6MW464.95FormulaC21H29ClN6O4
CAS number
1783977-95-6
Molecular weight
464.95
Formula
C21H29ClN6O4
Solubility
DMSO : 20·83 mg/mL (44·80 mM; ultrasonic and warming and heat to 60°C)
InChIKey
IVOSTHCDPHGPAS-UHFFFAOYSA-N
Catalogue number
GC64546
Brand
GLPBIO
Computed properties PubChem CID 89701119 · TPSA 134 Ų · H-bond donors 4 · H-bond acceptors 6
TPSA
134 Ų
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
32

SMILES CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)OCC(=O)NCCN.Cl

Computed descriptors from PubChem (CID 89701119), 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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