ChemicalBook--->CAS DataBase List--->2598242-66-9

2598242-66-9

2598242-66-9 Structure

2598242-66-9 Structure
IdentificationBack Directory
[Name]

2-Pyridinecarboxylic acid, 6-(4-ethoxyphenyl)-4-methoxy-, 1-methylethyl ester
[CAS]

2598242-66-9
[Synonyms]

2-Pyridinecarboxylic acid, 6-(4-ethoxyphenyl)-4-methoxy-, 1-methylethyl ester
[Molecular Formula]

C18H21NO4
[MOL File]

2598242-66-9.mol
[Molecular Weight]

315.36
Chemical PropertiesBack Directory
[Boiling point ]

464.9±45.0 °C(Predicted)
[density ]

1.111±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMF: insol,DMSO: 3 mg/ml,Ethanol: insol,PBS (pH 7.2): insol
[form ]

A crystalline solid
[pka]

2.93±0.26(Predicted)
[color ]

Off-white to light yellow
[InChI]

1S/C18H21NO4/c1-5-22-14-8-6-13(7-9-14)16-10-15(21-4)11-17(19-16)18(20)23-12(2)3/h6-12H,5H2,1-4H3
[InChIKey]

VYEIBLWRGBQRPI-UHFFFAOYSA-N
[SMILES]

O=C(C1=CC(OC)=CC(C2=CC=C(OCC)C=C2)=N1)OC(C)C
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

10 - Combustible liquids
Hazard InformationBack Directory
[Uses]

NG-497 is a selective human adipose triglyceride lipase (ATGL) inhibitor that targets the enzymatically active patatin-like domain of human ATGL. NG-497 has potential value for tumor research[1].
[Biological Activity]

NG-497 is a non-cytotoxicsubstrate-competitivereversible and highly selective human/primate adipose triglyceride lipase (ATGL; IPLA2-zeta; PNPLA2) inhibitor (IC50 = 1 μMKi = 0.5 μM) with little activity toward related human lipid hydrolases or ATGL orthologues from other species (<20% inhibition of mouseratgoatpigdogmarmoset ATGL at 50 μM). NG-497 abolishes hormone-induced lipolysis in human adipocytes (IC50 = 1.5 and 0.5 μM against 1 μM isoproterenol-induced total or hormonesensitive lipase (HSL)-independent FA release in Simpson-Golabi-Behmel syndrome adipocytes)but not in HepG2 th at lacks ATGL hydrolase activity.
[References]

[1] Gernot F Grabner, et al. Small-Molecule Inhibitors Targeting Lipolysis in Human Adipocytes. J Am Chem Soc. 2022 Apr 13;144(14):6237-6250. DOI:10.1021/jacs.1c10836
Spectrum DetailBack Directory
[Spectrum Detail]

2-Pyridinecarboxylic acid, 6-(4-ethoxyphenyl)-4-methoxy-, 1-methylethyl ester(2598242-66-9)1HNMR
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