Products 2444011-29-2

CAS 2444011-29-2 is the registry number for Linagliptin impurity 22, 97.0%. Offered by: MedChemExpress. Available pack sizes: 5 mg, 1 mg.

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

Methyl 2-[[(3R)-1-[7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-2,6-dioxopurin-8-yl]piperidin-3-yl]carbamoyl]benzoate (CAS 2444011-29-2) is a chemical compound with the molecular formula C34H34N8O5 and a molecular weight of 634.7 g/mol. IUPAC name: methyl 2-[[(3R)-1-[7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-2,6-dioxopurin-8-yl]piperidin-3-yl]carbamoyl]benzoate. InChIKey: VJDPONPEFFXYCK-JOCHJYFZSA-N.

Identity
Molecular formulaC34H34N8O5
Molecular weight634.7 g/mol
IUPAC namemethyl 2-[[(3R)-1-[7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-2,6-dioxopurin-8-yl]piperidin-3-yl]carbamoyl]benzoate
InChIKeyVJDPONPEFFXYCK-JOCHJYFZSA-N
SMILESCC#CCN1C2=C(N=C1N3CCC[C@H](C3)NC(=O)C4=CC=CC=C4C(=O)OC)N(C(=O)N(C2=O)CC5=NC6=CC=CC=C6C(=N5)C)C

Computed by PubChem (NCBI)