Linagliptin impurity 3

cas: 2983074-55-9 — see every product listed under this CAS number, including other names

Linagliptin impurity 3 (CAS 2983074-55-9) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas2983074-55-9
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Structural formula: {0} (CAS {1})

[(3R)-1-[7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-2,6-dioxopurin-8-yl]piperidin-3-yl]urea (CAS 2983074-55-9) is a chemical compound with the molecular formula C26H29N9O3 and a molecular weight of 515.6 g/mol. IUPAC name: [(3R)-1-[7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-2,6-dioxopurin-8-yl]piperidin-3-yl]urea. InChIKey: QWRPIDPNVOGFFM-QGZVFWFLSA-N.

Identity
Molecular formulaC26H29N9O3
Molecular weight515.6 g/mol
IUPAC name[(3R)-1-[7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-2,6-dioxopurin-8-yl]piperidin-3-yl]urea
InChIKeyQWRPIDPNVOGFFM-QGZVFWFLSA-N
SMILESCC#CCN1C2=C(N=C1N3CCC[C@H](C3)NC(=O)N)N(C(=O)N(C2=O)CC4=NC5=CC=CC=C5C(=N4)C)C

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