CAS 131707-25-0

Ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(phenylthio)methyl]-1H-indole-3-carboxylate

Description:

Ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(phenylthio)methyl]-1H-indole-3-carboxylate, with the CAS number 131707-25-0, is a complex organic compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. This substance features several functional groups, including a carboxylate ester, a bromo substituent, and a dimethylamino group, which contribute to its chemical reactivity and potential biological activity. The presence of the hydroxy group suggests it may participate in hydrogen bonding, influencing its solubility and interaction with other molecules. Additionally, the phenylthio group may enhance its lipophilicity, affecting its pharmacokinetic properties. This compound is likely to be of interest in medicinal chemistry, particularly in the development of pharmaceuticals, due to its structural complexity and the potential for diverse biological interactions. However, specific applications and safety profiles would require further investigation and empirical data.

Formula: C₂₂H₂₅BrN₂O₃S

InChI: InChI=1S/C22H25BrN2O3S/c1-5-28-22(27)20-18(13-29-14-9-7-6-8-10-14)25(4)17-11-16(23)21(26)15(19(17)20)12-24(2)3/h6-11,26H,5,12-13H2,1-4H3

InChI key: InChIKey=KCFYEAOKVJSACF-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C=1C=2C(N(C)C1CSC3=CC=CC=C3)=CC(Br)=C(O)C2CN(C)C

Synonyms:

• 1H-Indole-3-carboxylic acid, 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(phenylthio)methyl]-, ethyl ester
• 6-bromo-4-(2-methoxy-methyl)-5-hydroxy-1-methyl-2-(S-methyl benzene)-1-Indole-3-carboxylic acid ethyl ester
• Brd 1242
• Ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(phenylthio)methyl]-1H-indole-3-carboxylate
• Ethyl 6-bromo-5-hydroxy-1-methyl-4-((dimethylamino)methyl)-2-[(phenylthio)methyl]-1H-indole-3-carboxylate
• Ethyl6-Bromo-4-((Dimethylamino)Methyl)-5-Hydroxy-1-Methyl
• Intermediate:
• Umifenovir
• ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
• Aribidol

Umifenovir

CAS: 131707-25-0

Purity: 98%

Color and Shape: Solid

Molecular weight: 477.420013427734

Ref: 10-F600385

1H-Indole-3-carboxylic acid, 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(phenylthio)methyl]-, ethyl ester

CAS: 131707-25-0

Formula: C₂₂H₂₅BrN₂O₃S

Purity: 98%

Color and Shape: Solid

Molecular weight: 477.4145

Ref: IN-DA000ZLT

Arbidol

CAS: 131707-25-0

Arbidol (Umifenovir) is a broad-spectrum antiviral compound that is a fusion inhibitor and interacts with the SARS-CoV-2 spicin.

Formula: C₂₂H₂₅BrN₂O₃S

Purity: 99.57%

Color and Shape: White To Off-White Crystalline Powder

Molecular weight: 477.42

Ref: TM-T7911

Umifenovir

CAS: 131707-25-0

Applications Umifenovir is an intermediate in synthesizing Arbidol Sulfoxide (A766005), a metabolite of Arbidol (A766000) which is a medicinal agent for treating viral infections.
References Chiou, W., et al.: J. Pharm. Sci., 60, 1281 (1971), Ford, J., et al.: J. Pharm. Pharmacol., 31, 726 (1979), Tamblyn, S., et al.: Eur. J. Epidemiol., 10, 503 (1994), Suzuki, H., et al.: Chem. Pharm. Bull., 45, 1688 (1997),

Formula: C₂₂H₂₅BrN₂O₃S

Color and Shape: Neat

Molecular weight: 477.41

Ref: TR-U850185

Umifenovir

Controlled Product

CAS: 131707-25-0

Umifenovir is a drug that is being investigated for the treatment of infectious diseases. It has been shown to reduce viral load and have antiviral effects against an influenza virus in cell culture at concentrations of 3-5 μM. Umifenovir may also inhibit the activity of polymerase chain reaction, which is the process by which DNA is replicated. Umifenovir has not been tested on humans for safety or efficacy, but it has been shown to be safe in preclinical animal studies. This drug may be effective against other types of viruses as well.

Formula: C₂₂H₂₅BrN₂O₃S

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 477.42 g/mol

Ref: 3D-AU176627

6-Bromo-1,2,4-trimethyl-1H-indol-5-ol

Controlled Product

CAS: 131707-25-0

Formula: C₁₁H₁₂BrNO

Color and Shape: Neat

Molecular weight: 254.123

Ref: TR-A766015