7-(2-Butyn-1-yl)-3,7-dihydro-8-[(3R)-3-hydroxy-1-piperidinyl]-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]-1H-purine-2,6-dione, 95%

cas: 2803369-89-1 — see every product listed under this CAS number, including other names

7-(2-Butyn-1-yl)-3,7-dihydro-8-[(3R)-3-hydroxy-1-piperidinyl]-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]-1H-purine-2,6-dione, 95% (CAS 2803369-89-1) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 25mg, 50mg. Offered by: Chemat.

• 2D
• 3D

7-but-2-ynyl-8-[(3R)-3-hydroxypiperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione (CAS 2803369-89-1) is a chemical compound with the molecular formula C25H27N7O3 and a molecular weight of 473.5 g/mol. IUPAC name: 7-but-2-ynyl-8-[(3R)-3-hydroxypiperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione. InChIKey: QAHWUJQHJPWQGS-QGZVFWFLSA-N.

Identity

Molecular formula	C25H27N7O3
Molecular weight	473.5 g/mol
IUPAC name	7-but-2-ynyl-8-[(3R)-3-hydroxypiperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione
InChIKey	QAHWUJQHJPWQGS-QGZVFWFLSA-N
SMILES	CC#CCN1C2=C(N=C1N3CCC[C@H](C3)O)N(C(=O)N(C2=O)CC4=NC5=CC=CC=C5C(=N4)C)C

Computed by PubChem (NCBI)

Synonyms: 3-Deamino 3-Hydroxy Linagliptin

Related forms of this compound

7-but-2-ynyl-8-[(3S)-3-hydroxypiperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione C₂₅H₂₇N₇O₃

Isomers (same molecular formula)

cyclopropyl-[5-[[4-[4-[[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]methyl]-3-methylpyrazol-1-yl]pyrimidin-2-yl]amino]-1-methylindol-3-yl]methanone C₂₅H₂₇N₇O₃

6-(1-methylpyrazol-4-yl)-2-[[3-[5-(2-morpholin-4-ylethoxy)pyrimidin-2-yl]phenyl]methyl]pyridazin-3-one C₂₅H₂₇N₇O₃