ChemicalBook--->CAS DataBase List--->118666-03-8

118666-03-8

118666-03-8 Structure

118666-03-8 Structure
IdentificationBack Directory
[Name]

Acetic acid, 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-, ethyl ester
[CAS]

118666-03-8
[Synonyms]

HTS07545
Acetic acid, 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-, ethyl ester
[Molecular Formula]

C22H18N2O3
[MOL File]

118666-03-8.mol
[Molecular Weight]

358.39
Chemical PropertiesBack Directory
[Melting point ]

136-137 °C
[Boiling point ]

513.3±50.0 °C(Predicted)
[density ]

1.25±0.1 g/cm3(Predicted)
[form ]

Solid
[pka]

-0.98±0.30(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

HTS07545 is a potent sulfide:quinone oxidoreductase (SQOR) inhibitor with an IC50 of 30 nM. HTS07545 decrease the rate of breakdown of hydrogen sulfide (H2S). HTS07545 can be used for heart failure research[1].
[References]

[1] Simon D P Baugh, et al. Synthesis and evaluation of potent novel inhibitors of human sulfide:quinone oxidoreductase. Bioorg Med Chem Lett. 2021 Dec 15;54:128443. DOI:10.1016/j.bmcl.2021.128443
Spectrum DetailBack Directory
[Spectrum Detail]

Acetic acid, 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-, ethyl ester(118666-03-8)1HNMR
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