Products 2459963-12-1

CAS 2459963-12-1 appears in our catalog under these names: Xanthine amine congener trihydrochloride/ 97.85% (existing batch purity), Xanthine Amine Congener Trihydrochloride, Xanthine amine congener (trihydrochloride). Offered by: TargetMol, Chemat, MedChemExpress. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 100mg, Get quote.

Structural formula: {0} (CAS {1})

N-(2-aminoethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxy]acetamide;trihydrochloride (CAS 2459963-12-1) is a chemical compound with the molecular formula C21H31Cl3N6O4 and a molecular weight of 537.9 g/mol. IUPAC name: N-(2-aminoethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxy]acetamide;trihydrochloride. InChIKey: CINSWTDBZPHLML-UHFFFAOYSA-N.

Identity
Molecular formulaC21H31Cl3N6O4
Molecular weight537.9 g/mol
IUPAC nameN-(2-aminoethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxy]acetamide;trihydrochloride
InChIKeyCINSWTDBZPHLML-UHFFFAOYSA-N
SMILESCCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)OCC(=O)NCCN.Cl.Cl.Cl

Computed by PubChem (NCBI)