Products 1638544-63-4

CAS 1638544-63-4 is the registry number for Alogliptin Impurity 52. Offered by: Chemat Brand. Available pack sizes: on request.

Alogliptin Impurity 52
Chemat Brand
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  • Variants: 1
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4-[[6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile;benzoic acid (CAS 1638544-63-4) is a chemical compound with the molecular formula C25H27N5O4 and a molecular weight of 461.5 g/mol. IUPAC name: 4-[[6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile;benzoic acid. InChIKey: RDDTZEOYEAADOY-XFULWGLBSA-N.

Identity
Molecular formulaC25H27N5O4
Molecular weight461.5 g/mol
IUPAC name4-[[6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile;benzoic acid
InChIKeyRDDTZEOYEAADOY-XFULWGLBSA-N
SMILESCN1C(=O)C=C(N(C1=O)CC2=CC=C(C=C2)C#N)N3CCC[C@H](C3)N.C1=CC=C(C=C1)C(=O)O

Computed by PubChem (NCBI)

Isomers (same molecular formula)
2-[[6-[(3S)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile;benzoic acid C25H27N5O4
2-[[6-[(3R)-3-aminopiperidin-1-yl]-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile;benzoic acid C25H27N5O4