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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Saxagliptin

N#C[C@@H]1C[C@H]2[C@@H](N1C(=O)[C@H](C13CC4CC(C1)CC(C3)(C4)O)N)C2.O Request for Quotation
Chemical Name: Saxagliptin
CAS Number: 945667-22-1
Product Number: AG003A9U(AGN-PC-0W473W)
Synonyms:
MDL No:
Molecular Formula: C18H27N3O3
Molecular Weight: 333.4253

Identification/Properties

Computed Properties
Molecular Weight:
333.432g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
333.205g/mol
Monoisotopic Mass:
333.205g/mol
Topological Polar Surface Area:
91.4A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
609
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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Chemical Structure


The compound (1S,3S,5S)-2-[(2S)-2-Amino-2-(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrile hydrate (1:1) is a versatile building block in chemical synthesis. With its unique structure and functional groups, this compound is commonly used in the synthesis of complex molecules and pharmaceutical intermediates. Its three-dimensional arrangement and chirality make it particularly valuable in asymmetric synthesis and the creation of bioactive compounds. Additionally, the presence of a carbonitrile group allows for further functionalization through various chemical transformations, expanding its synthetic utility. This compound plays a crucial role in the development and production of diverse chemical entities with applications in pharmaceuticals, agrochemicals, and materials science.