LY3039478


Chemical Name: LY3039478
CAS Number: 1421438-81-4
Product Number: AG001HUJ(AGN-PC-0WALBN)
Synonyms:
MDL No:
Molecular Formula: C22H23F3N4O4
Molecular Weight: 464.4376

Identification/Properties


Computed Properties
Molecular Weight:
464.445g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
464.167g/mol
Monoisotopic Mass:
464.167g/mol
Topological Polar Surface Area:
112A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
720
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



N-[(1S)-2-[[(7S)-6,7-Dihydro-5-(2-hydroxyethyl)-6-oxo-5H-pyrido[3,2-a][3]benzazepin-7-yl]amino]-1-methyl-2-oxoethyl]-4,4,4-trifluorobutanamide, also known as $name$, is a valuable compound in chemical synthesis. This molecule plays a crucial role in organic synthesis as a versatile building block due to its unique structural features. $name$ acts as a key intermediate in the creation of various pharmaceuticals, agrochemicals, and materials.In chemical synthesis, $name$ can be utilized as a crucial component in the construction of complex molecular structures. Its specific functional groups enable selective chemical reactions that lead to the formation of intricate chemical compounds with tailored properties. By leveraging the reactivity of $name$, chemists can access a diverse range of potential products with enhanced functionalities.Moreover, the presence of the trifluorobutanamide group in $name$ enhances the compound's stability and compatibility with a wide range of reaction conditions. This characteristic makes $name$ a reliable building block for the synthesis of advanced organic molecules in both academic research and industrial applications.Overall, the strategic incorporation of N-[(1S)-2-[[(7S)-6,7-Dihydro-5-(2-hydroxyethyl)-6-oxo-5H-pyrido[3,2-a][3]benzazepin-7-yl]amino]-1-methyl-2-oxoethyl]-4,4,4-trifluorobutanamide in chemical synthesis opens up exciting possibilities for the development of novel compounds with diverse functionalities and applications.