CAS 2504-32-7

1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid

Description:

1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid, with the CAS number 2504-32-7, is a chemical compound that belongs to the class of indole derivatives. This substance features a complex structure characterized by an indole ring, which is a bicyclic structure composed of a benzene ring fused to a pyrrole ring. The presence of a 4-chlorobenzoyl group indicates that it has a chlorinated aromatic moiety, which can influence its biological activity and solubility. The hydroxy group at the 5-position and the acetic acid functional group contribute to its potential reactivity and interaction with biological systems. This compound may exhibit various pharmacological properties, making it of interest in medicinal chemistry and drug development. Its specific characteristics, such as solubility, melting point, and stability, would depend on the molecular interactions and the environment in which it is studied. Overall, this compound represents a unique structure that may have applications in therapeutic contexts.

Formula: C₁₈H₁₄ClNO₄

InChI: InChI=1S/C18H14ClNO4/c1-10-14(9-17(22)23)15-8-13(21)6-7-16(15)20(10)18(24)11-2-4-12(19)5-3-11/h2-8,21H,9H2,1H3,(H,22,23)

InChI key: InChIKey=KMLNWQPYFBIALN-UHFFFAOYSA-N

SMILES: C(=O)(N1C=2C(C(CC(O)=O)=C1C)=CC(O)=CC2)C3=CC=C(Cl)C=C3

Synonyms:

• 1-(4-Chlorobenzoyl)-5-Hydroxy-2-Methyl-3-Indoleacetic Acid
• 1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid
• 1-(p-Chlorobenzoyl)-5-hydroxy-2-methylindole-3-acetic acid
• 1H-indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-hydroxy-2-methyl-
• 2-(1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indol-3-yl)acetic acid
• 5-Hydroxyindomethacin
• Demethylindomethacin
• Desmethylindomethacin
• Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-hydroxy-2-methyl-
• O-Desmethylindomethacin

5-hydroxy Indomethacin

CAS: 2504-32-7

Formula: C₁₈H₁₄ClNO₄

Color and Shape: Solid

Molecular weight: 343.7611

Ref: IN-DA002Q9T

O-Desmethyl Indomethacin

CAS: 2504-32-7

Formula: C₁₈H₁₄ClNO₄

Color and Shape: Off-White Solid

Molecular weight: 343.76

Ref: 4Z-I-124

5-hydroxy Indomethacin

CAS: 2504-32-7

5-hydroxy Indomethacin is a metabolite of indomethacin .1It is formed from indomethacin in rabbit hepatic microsomes.

Formula: C₁₈H₁₄ClNO₄

Color and Shape: Solid

Molecular weight: 343.76

Ref: TM-T37210

O-Desmethyl Indomethacin

Controlled Product

CAS: 2504-32-7

Applications The major metabolite of Indomethacin.
References Lewis, R., et al.: J. Clin. Invest., 53, 1607 (1974), Alvan, G., et al.: Clin. Pharmacol. Ther., 18, 364 (1975), Mungall, D., et al.: J. Pharm. Sci., 73, 1000 (1984), Baldwin, S., et al.: Xenobiotica, 25, 261 (1995),

Formula: C₁₈H₁₄ClNO₄

Color and Shape: Neat

Molecular weight: 343.76

Ref: TR-D291800

O-Desmethyl indomethacin

CAS: 2504-32-7

O-Desmethyl indomethacin is a metabolite of indomethacin that has been shown to be a potent cytotoxic agent and may have potential as an anticancer drug. It inhibits the mitochondrial membrane potential in HL60 cells, which causes significant cytotoxicity. The target tissue for O-desmethyl indomethacin is not known, but it has been shown to be effective against cancer cells in clinical studies. O-Desmethyl indomethacin binds to glucocorticoid receptors in the cytoplasm and inhibits organic anion transporters, leading to its accumulation in urine samples. Studies have also shown that O-desmethyl indomethacin is excreted by infants through breast milk and eliminated with other metabolites through the preparative high performance liquid chromatography (HPLC).

Formula: C₁₈H₁₄ClNO₄

Purity: Min. 95%

Molecular weight: 343.76 g/mol

Ref: 3D-FD21281

O-Desmethyl Indomethacin

CAS: 2504-32-7

Formula: C₁₈H₁₄ClNO₄

Molecular weight: 343.76

Ref: ST-EA-CP-I7025