7-(But-2-yn-1-yl)-8-ethoxy-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-1H-purine-2,6(3H,7H)-dione (Linagliptin Impurity), 95%

cas: 1803079-48-2 — see every product listed under this CAS number, including other names

7-(But-2-yn-1-yl)-8-ethoxy-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-1H-purine-2,6(3H,7H)-dione (Linagliptin Impurity), 95% (CAS 1803079-48-2) is a chemical reagent available from Chemat. Available pack sizes: 50mg. Offered by: Fluorochem.

• 2D
• 3D

7-but-2-ynyl-8-ethoxy-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione (CAS 1803079-48-2) is a chemical compound with the molecular formula C22H22N6O3 and a molecular weight of 418.4 g/mol. IUPAC name: 7-but-2-ynyl-8-ethoxy-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione. InChIKey: HAGSIEOHWJJRAJ-UHFFFAOYSA-N.

Identity

Molecular formula	C22H22N6O3
Molecular weight	418.4 g/mol
IUPAC name	7-but-2-ynyl-8-ethoxy-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione
InChIKey	HAGSIEOHWJJRAJ-UHFFFAOYSA-N
SMILES	CCOC1=NC2=C(N1CC#CC)C(=O)N(C(=O)N2C)CC3=NC4=CC=CC=C4C(=N3)C

Computed by PubChem (NCBI)

Synonyms: Linagliptin impurity N1, Linagliptin Impurity 171, orb3181429

Isomers (same molecular formula)

2-methoxy-4-N,4-N-dimethyl-1-N-[4-(1-methylindol-3-yl)pyrimidin-2-yl]-5-nitrobenzene-1,4-diamine C₂₂H₂₂N₆O₃

(2R,3S,5R)-5-[6-amino-8-(4-phenylanilino)purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol C₂₂H₂₂N₆O₃

1-[(3S)-3-[4-amino-3-[2-(3,5-dimethoxyphenyl)ethynyl]pyrazolo[3,4-d]pyrimidin-1-yl]pyrrolidin-1-yl]prop-2-en-1-one C₂₂H₂₂N₆O₃

4-[[5-methoxy-6-[(5-methoxy-2-pyridinyl)methoxy]-3-pyridinyl]methyl]-2-(1-methylpyrazol-4-yl)pyrimidine C₂₂H₂₂N₆O₃