Products 1398044-43-3

CAS 1398044-43-3 appears in our catalog under these names: Linagliptin-13C-d3, Linagliptin-13C,d3. Offered by: Chemat Brand, TRC, MedChemExpress. Available pack sizes: on request, 50mg, 1 mg.

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

8-[(3R)-3-aminopiperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-7-(4,4,4-trideuterio(413C)but-2-ynyl)purine-2,6-dione (CAS 1398044-43-3) is a chemical compound with the molecular formula C25H28N8O2 and a molecular weight of 476.6 g/mol. IUPAC name: 8-[(3R)-3-aminopiperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-7-(4,4,4-trideuterio(413C)but-2-ynyl)purine-2,6-dione. InChIKey: LTXREWYXXSTFRX-AJOAJEKUSA-N.

Identity
Molecular formulaC25H28N8O2
Molecular weight476.6 g/mol
IUPAC name8-[(3R)-3-aminopiperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-7-(4,4,4-trideuterio(413C)but-2-ynyl)purine-2,6-dione
InChIKeyLTXREWYXXSTFRX-AJOAJEKUSA-N
SMILES[2H][13C]([2H])([2H])C#CCN1C2=C(N=C1N3CCC[C@H](C3)N)N(C(=O)N(C2=O)CC4=NC5=CC=CC=C5C(=N4)C)C

Computed by PubChem (NCBI)