Elafibranor | CAS No. 923978-27-2

Elafibranor

Basic Information

View in Editor

CAS Number

923978-27-2

Molecular Formula

C22H24O4S

Molecular Weight

384.5 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

569.0±50.0°C at 760 mmHg

SMILES

View in Editor

CC1=CC(=CC(=C1OC(C)(C)C(=O)O)C)C=CC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C22H24O4S/c1-14-12-16(13-15(2)20(14)26-22(3,4)21(24)25)6-11-19(23)17-7-9-18(27-5)10-8-17/h6-13H,1-5H3,(H,24,25)/b11-6+

InChIKey

AFLFKFHDSCQHOL-IZZDOVSWSA-N

LogP

5.163440000000005

Topological Polar Surface Area

63.6 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

537

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

GFT505
elafibranor E
GFT-505
Elafibranor(GFT505)
Elafibranor
Elafibranor [USAN]
2J3H5C81A5
Elafibranor (USAN)
(E)-2-(2,6-dimethyl-4-(3-(4-(methylthio)phenyl)-3-oxoprop-1-enyl)phenoxy)-2-methylpropanoic acid
Elafibranor [INN]
GFT 505
2-[2,6-dimethyl-4-[(E)-3-(4-methylsulfanylphenyl)-3-oxoprop-1-enyl]phenoxy]-2-methylpropanoic acid
BCP19067
s3720
DB05187
SB16790
(E)-2-(2,6-dimethyl-4-(3-(4-(methylthio)phenyl)-3-oxoprop-1-en-1-yl)phenoxy)-2-methylpropanoic acid
2-{2,6-dimethyl-4-[(1E)-3-[4-(methylsulfanyl)phenyl]-3-oxoprop-1-en-1-yl]phenoxy}-2-methylpropanoic acid
SureCN815512
S
2-[2,6-Dimethyl-4-[(1E)-3-[4-(methylthio)phenyl]-3-oxo-1-propen-1-yl]phenoxy]-2-methylpropanoic acid (ACI)
(E)-1-[4-(Methylthio)phenyl]-3-[3,5-dimethyl-4-[(carboxydimethylmethyl)oxy]phenyl]prop-2-en-1-one
Elafibranor(GFT505)?
SCHEMBL815512
TS-09870
AC-35189
NS00073370
DTXSID601045330
HY-16737
(E/Z)-Elafibranor
Iqirvo

MDL Number

MFCD27987940

FAQ

What are the physical and chemical properties of Elafibranor (CAS: 923978-27-2)?

Elafibranor (CAS: 923978-27-2) is a crystalline white to off-white powder. It has a molecular weight of approximately 481.38 g/mol. Elafibranor is slightly soluble in water and has low solubility in organic solvents. It is relatively stable under normal conditions but may react with strong acids or bases. Elafibranor is of interest due to its pharmacological activities.

How is Elafibranor (CAS: 923978-27-2) typically synthesized?

Elafibranor (CAS: 923978-27-2) is typically synthesized via multi-step organic synthesis involving protection and deprotection of functional groups. The synthesis often employs palladium catalysts for cross-coupling reactions, ensuring high selectivity and yield. The final step involves purification by crystallization from a suitable solvent.

What industries use Elafibranor (CAS: 923978-27-2)?

Elafibranor (CAS: 923978-27-2) is primarily used in the pharmaceutical industry for its potential therapeutic benefits. It has been studied for its effects on metabolic disorders and has shown promise in treating non-alcoholic steatohepatitis (NASH). It is also of interest in research for its potential applications in diabetes and other metabolic diseases.

What precautions should be taken when handling Elafibranor (CAS: 923978-27-2)?

When handling Elafibranor (CAS: 923978-27-2), it is important to use personal protective equipment (PPE) such as gloves, lab coat, and safety glasses. Work should be conducted in a well-ventilated area or fume hood. Spills should be cleaned up immediately using appropriate materials, and the Material Safety Data Sheet (MSDS) should be consulted for specific spill procedures. Proper storage in a cool, dry place away from strong acids and bases is recommended.