Products 865999-68-4

CAS 865999-68-4 is the registry number for Saxagliptin Impurity 30. Offered by: Chemat Brand. Available pack sizes: on request.

Saxagliptin Impurity 30
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

[3-[(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxo-1-[(2,2,2-trifluoroacetyl)amino]ethyl]-1-adamantyl] 2,2,2-trifluoroacetate (CAS 865999-68-4) is a chemical compound with the molecular formula C22H23F6N3O4 and a molecular weight of 507.4 g/mol. IUPAC name: [3-[(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxo-1-[(2,2,2-trifluoroacetyl)amino]ethyl]-1-adamantyl] 2,2,2-trifluoroacetate. InChIKey: JHYOJFWKXPRGIA-XZHPEASHSA-N.

Identity
Molecular formulaC22H23F6N3O4
Molecular weight507.4 g/mol
IUPAC name[3-[(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hexan-2-yl]-2-oxo-1-[(2,2,2-trifluoroacetyl)amino]ethyl]-1-adamantyl] 2,2,2-trifluoroacetate
InChIKeyJHYOJFWKXPRGIA-XZHPEASHSA-N
SMILESC1[C@@H]2C[C@@H]2N([C@@H]1C#N)C(=O)[C@H](C34CC5CC(C3)CC(C5)(C4)OC(=O)C(F)(F)F)NC(=O)C(F)(F)F

Computed by PubChem (NCBI)