COX-2-IN-36

Names

[ CAS No. ]:
189954-93-6

[ Name ]:
COX-2-IN-36

[Synonym ]:
5(S)-ethyl-5-methyl-4-(4-(methylsulfonyl)phenyl)-3-(2-propoxy)-5H-furan-2-one
5(S)-5-ethyl-5-methyl-4-(4-(methylsulfonyl)phenyl)-3-(2-propoxy)-5H-furan-2-one
(S)-5-ethyl-3-isopropoxy-5-methyl-4-[4-(methylsulfonyl)phenyl]furan-2(5H)-one
(5S)-5-ethyl-3-isopropoxy-5-methyl-4-[4-(methylsulfonyl)phenyl]furan-2(5H)-one
(5S) 5-ethyl-5-methyl-4-(4-(methylsulfonyl)phenyl)-3-(2-propoxy)-5H-furan-2-one
(S)-5-Ethyl-3-isopropoxy-4-(4-methanesulfonyl-phenyl)-5-methyl-5H-furan-2-one
(5S)-ethyl-5-methyl-4-(4-(methanesulfonyl)phenyl)-3-(2-propoxy)-(5H)-furan-2-one

Biological Activity

[Description]:

COX-2-IN-36 (compound 1) is a very potent and specific COX-2 inhibitor, with an IC50 of 0.4 μM[1][2].

[Related Catalog]:

Research Areas >> Inflammation/Immunology
Signaling Pathways >> Immunology/Inflammation >> COX

[Target]

IC50: 0.4 μM (COX-2)[2].


[References]

[1]. Lushi Tan, et al. Practical enantioselective synthesis of a COX-2 specific inhibitor. TetrahedronVolume 58, Issue 37, 9 September 2002, Pages 7403-7410.

[2]. Yves Leblanc, et al. Discovery of a potent and selective COX-2 inhibitor in the alkoxy lactone series with optimized metabolic profile. Bioorg Med Chem Lett. 2002 Nov 18;12(22):3317-20.  

Chemical & Physical Properties

[ Molecular Formula ]:
C17H22O5S

[ Molecular Weight ]:
338.41900

[ Exact Mass ]:
338.11900

[ PSA ]:
78.05000

[ LogP ]:
4.03250