Montelukast Methyl Ketone


Chemical Name: Montelukast Methyl Ketone
CAS Number: 937275-23-5
Product Number: AG00GXWH(AGN-PC-0WAE6C)
Synonyms:
MDL No: MFCD19705146
Molecular Formula: C34H32ClNO3S
Molecular Weight: 570.14078

Identification/Properties


Computed Properties
Molecular Weight:
570.144g/mol
XLogP3:
7.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
12
Exact Mass:
569.179g/mol
Monoisotopic Mass:
569.179g/mol
Topological Polar Surface Area:
92.6A^2
Heavy Atom Count:
40
Formal Charge:
0
Complexity:
890
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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



Montelukast Methyl Ketone is a valuable intermediate in chemical synthesis, commonly used as a building block in the production of various pharmaceutical compounds. Due to its unique structure and reactivity, this compound serves as a key component in the synthesis of Montelukast, a potent leukotriene receptor antagonist used in the treatment of asthma and seasonal allergies. By incorporating Montelukast Methyl Ketone into different reaction schemes, chemists can efficiently access complex molecules with specific pharmacological properties. Furthermore, the versatility of this compound allows for the development of novel drug candidates and research chemicals, making it a crucial tool in modern drug discovery efforts.