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105603-49-4

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105603-49-4 Usage

Description

Methyl 5-bromo-2,3-dihydroxybenzoate is an organic compound characterized by its pale yellow solid appearance. It is a derivative of benzoic acid with a methyl group attached to the benzene ring and features a bromine atom at the 5-position, along with two hydroxyl groups at the 2 and 3 positions. methyl 5-bromo-2,3-dihydroxybenzoate is known for its potential applications in various fields due to its unique chemical structure and properties.

Uses

1. Pharmaceutical Industry:
Methyl 5-bromo-2,3-dihydroxybenzoate is used as an intermediate in the synthesis of pharmaceutical compounds, specifically for the preparation of hydroxyalbuterol. Hydroxyalbuterol is a medication used to treat conditions like asthma and chronic obstructive pulmonary disease (COPD). The compound's unique structure allows it to be a key component in the development of these therapeutic agents.
2. Biochemical Research:
In the field of biochemical research, methyl 5-bromo-2,3-dihydroxybenzoate is utilized as a bisubstrate inhibitor. It displays low inhibitory activity towards sn-glycerol-3-phosphate oxidase, an enzyme found in Trypanosoma brucei brucei, which is the causative agent of African sleeping sickness. By inhibiting this enzyme, the compound can potentially contribute to the development of treatments for this disease.
3. Chemical Synthesis:
Methyl 5-bromo-2,3-dihydroxybenzoate can also be used as a starting material or building block in the synthesis of other organic compounds. Its unique functional groups and structural features make it a valuable component in the creation of various chemical products, including those with potential applications in different industries such as agriculture, materials science, and environmental science.

Check Digit Verification of cas no

The CAS Registry Mumber 105603-49-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,5,6,0 and 3 respectively; the second part has 2 digits, 4 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 105603-49:
(8*1)+(7*0)+(6*5)+(5*6)+(4*0)+(3*3)+(2*4)+(1*9)=94
94 % 10 = 4
So 105603-49-4 is a valid CAS Registry Number.

105603-49-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 5-bromo-2,3-dihydroxybenzoate

1.2 Other means of identification

Product number -
Other names 5-bromo-2,3-dihydroxybenzoic acid methyl ester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:105603-49-4 SDS

105603-49-4Relevant articles and documents

POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M1

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, (2020/05/28)

Described are positive allosteric modulators of muscarinic acetylcholine receptor M1 (mAChR M1), pharmaceutical compositions including the compounds, and methods of using the compounds and compositions for treating neurological disorders, psychiatric diso

Molecular recognition at the active site of catechol-O-methyltransferase (COMT): Adenine replacements in bisubstrate inhibitors

Ellermann, Manuel,Paulini, Ralph,Jakob-Roetne, Roland,Lerner, Christian,Borroni, Edilio,Roth, Doris,Ehler, Andreas,Schweizer, W. Bernd,Schlatter, Daniel,Rudolph, Markus G.,Diederich, Francois

, p. 6369 - 6381 (2011/08/06)

L-Dopa, the standard therapeutic for Parkinson's disease, is inactivated by the enzyme catechol-O-methyltransferase (COMT). COMT catalyzes the transfer of an activated methyl group from S-adenosylmethionine (SAM) to its catechol substrates, such as L-dopa, in the presence of magnesium ions. The molecular recognition properties of the SAM-binding site of COMT have been investigated only sparsely. Here, we explore this site by structural alterations of the adenine moiety of bisubstrate inhibitors. The molecular recognition of adenine is of special interest due to the great abundance and importance of this nucleobase in biological systems. Novel bisubstrate inhibitors with adenine replacements were developed by structure-based design and synthesized using a nucleosidation protocol introduced by Vorbrueggen and co-workers. Key interactions of the adenine moiety with COMT were measured with a radiochemical assay. Several bisubstrate inhibitors, most notably the adenine replacements thiopyridine, purine, N-methyladenine, and 6-methylpurine, displayed nanomolar IC50 values (median inhibitory concentration) for COMT down to 6 nM. A series of six cocrystal structures of the bisubstrate inhibitors in ternary complexes with COMT and Mg2+ confirm our predicted binding mode of the adenine replacements. The cocrystal structure of an inhibitor bearing no nucleobase can be regarded as an intermediate along the reaction coordinate of bisubstrate inhibitor binding to COMT. Our studies show that solvation varies with the type of adenine replacement, whereas among the adenine derivatives, the nitrogen atom at position 1 is essential for high affinity, while the exocyclic amino group is most efficiently substituted by a methyl group. Copyright

Dual inhibitors of adipocyte fatty acid binding protein and keratinocyte fatty acid binding protein

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Page 63, (2010/02/06)

Compounds that are dual aP2/k-FABP inhibitors are provided having the formula wherein A, B, X, Y, R1, R2 and R3 are as described herein. A method is also provided for treating diabetes and related diseases, especially Type II diabetes, employing dual aP2/k-FABP inhibitors alone or in combination with at least one other antidiabetic agent such as metformin, glyburide, troglitazone and/or insulin.

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