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5-Hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylic acid ethyl ester, also known as ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate, is a chemical compound with the molecular formula C18H19NO3. It is a derivative of tryptophan, an essential amino acid, and is characterized by the presence of a hydroxyl group at the 5-position, a methyl group at the 2-position, and a phenyl group at the 1-position. The compound is an ester, with an ethyl group attached to the carboxylic acid group at the 3-position of the indole ring. This chemical is of interest in the field of organic chemistry and may have potential applications in pharmaceuticals or as an intermediate in the synthesis of other compounds. However, it is important to note that the specific uses, safety, and toxicity of 5-HYDROXY-2-METHYL-1-PHENYL-1H-INDOLE-3-CARBOXYLIC ACID ETHYL ESTER are not detailed in this summary, and further research or professional consultation would be required for detailed information.

5564-29-4

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5564-29-4 Usage

Chemical class

Ester

Structure

Complex

Derivative

Indole

Potential pharmaceutical applications

Ability to modulate biological processes and reactions in the body

Uses

Research and drug development as a potential therapeutic agent

Further studies needed

To fully understand pharmacological properties and potential uses in medicine

Check Digit Verification of cas no

The CAS Registry Mumber 5564-29-4 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,5,6 and 4 respectively; the second part has 2 digits, 2 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 5564-29:
(6*5)+(5*5)+(4*6)+(3*4)+(2*2)+(1*9)=104
104 % 10 = 4
So 5564-29-4 is a valid CAS Registry Number.
InChI:InChI=1/C18H17NO3/c1-3-22-18(21)17-12(2)19(13-7-5-4-6-8-13)16-10-9-14(20)11-15(16)17/h4-11,20H,3H2,1-2H3

5564-29-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name ETHYL 5-HYDROXY-2-METHYL-1-PHENYL-1H-INDOLE-3-CARBOXYLATE

1.2 Other means of identification

Product number -
Other names -

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 -
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More Details:5564-29-4 SDS

5564-29-4Relevant academic research and scientific papers

5-Hydroxyindole-based EZH2 inhibitors assembled via TCCA-catalyzed condensation and Nenitzescu reactions

Chen, Guoliang,Du, Fangyu,Sun, Wenjiao,Wang, Lihui,Wu, Chunfu,Yang, Cheng,Zhou, Qifan

, (2020/05/16)

5-Hydroxyindole derivatives have various demonstrated biological activities. Herein, we used 5-hydroxyindole as a synthetic starting point for structural alterations in a combinatorial process to synthesize 22 different compounds with EZH2 inhibitor pharmacophores. A series of 5-hydroxyindole-derived compounds were screened inhibitory activities against K562 cells. According to molecular modeling and in vitro biological activity assays, the preliminary structure-activity relationship was summarized. Compound L–04 improved both the H3K27Me3 reduction and antiproliferation parameters (IC50 = 52.6 μM). These findings revealed that compound L–04 is worthy of consideration as a lead compound to design more potent EZH2 inhibitors. During the preparation of compounds, we discovered that trichloroisocyanuric acid (TCCA) is a novel catalyst which demonstrates condensation-promoting effects. To gain insight into the reaction, in situ React IR technology was used to confirm the reactivity. Different amines were condensed in high yields with β-diketones or β-ketoesters in the presence of TCCA to afford the corresponding products in a short time (10~20 min), which displayed some advantages and provided an alternative condensation strategy.

α-d-Galacturonic Acid as Natural Ligand for Selective Copper-Catalyzed N-Arylation of N-Containing Heterocycles

Yuan, Chunling,Zhao, Yingdai,Zheng, Li

, p. 2173 - 2180 (2019/11/25)

The first application of α-d-galacturonic acid hydrate (GalA) is reported here, as a potential O-donor ligand. The C-N couplings of N-heterocycles with aryl halides or arylboronic acids could be readily conducted and exhibited good functional group tolerance with characters of selectivity. These N-Arylazoles allow rapid access to several pharmaceutical intermediates and can be easily transformed into a variety of other interesting scaffolds as well.

Montmorillonite clay catalyzed three component, one-pot synthesis of 5-Hydroxyindole derivatives

Reddy, B.V.Subba,Reddy, P. Sivaramakrishna,Reddy, Y. Jayasudhan,Bhaskar,Reddy, B. Chandra Obula

, p. 2968 - 2972 (2014/01/06)

A highly efficient and environmentally benign protocol has been developed for the first time to produce a wide range of biologically active 5-hydroxyindole derivatives using montmorillonite KSF clay as a reusable solid acid catalyst. The use of recyclable clay makes this procedure quite simple, more convenient and cost-effective.

Synthesis of the new ring system 2-oxo-[1,4]oxazino[3,2-e]indole, heteroanalogue of Angelicin

Barraja, Paola,Diana, Patrizia,Montalbano, Alessandra,Martorana, Annamaria,Carbone, Anna,Cirrincione, Girolamo

scheme or table, p. 4182 - 4184 (2009/12/01)

A convenient synthesis of the 2-oxo-[1,4]oxazino[3,2-e]indole ring system, an heteroanalogue of Angelicin, is reported. Our synthetic approach consisted of the annelation of the oxazine ring on the indole moiety using 4-amino-5-hydroxy indoles as building blocks. The antiproliferative activity of the new compounds either in the dark or under UVA irradiation was investigated.

Lewis acid catalyzed Nenitzescu indole synthesis

Velezheva, Valeriya S.,Kornienko, Albert G.,Topilin, Sergey V.,Turashev, Ascar D.,Peregudov, Alexander S.,Brennan, Patrick J.

, p. 873 - 879 (2007/10/03)

A novel method for Lewis acid catalyzed Nenitzescu indole syntheses of 5-hydroxyindoles bearing different substituents in positions 1 (Alk, Bn, Ar), 2 (Me, Et, Ph), and 3 (COOEt, COMe, CONHPh) as well as tricyclic derivatives are reported. The method is simple, rapid, efficient, and allows preparation of hydroxyindoles from 1,4-benzoquinone and enamines in good to excellent yields with the use of low-polar solvents in the presence of weak Lewis acids catalysts. The formation of 5-hydroxyindoles under such mild conditions is explained in terms of a non-redox mechanism.

A simple and effective approach to the synthesis of pyrido[4,3,2-mn]pyrrolo[3,2,1-de]acridine skeleton of arnoamines A and B, pentacyclic marine alkaloids from the ascidian Cystodytes sp.

Radchenko, Oleg S.,Balaneva, Nadezhda N.,Denisenko, Vladimir A.,Novikov, Vyacheslav L.

, p. 7819 - 7822 (2007/10/03)

Starting from ethyl 5-hydroxy-2-methyl-1-phenylindole-3-carboxylate, a simple and effective approach to the synthesis of pyrido[4,3,2-mn]pyrrolo[3,2,1-de]acridine skeleton of arnoamines A and B, unique pentacyclic alkaloids from the ascidian Cystodytes sp

Synthesis and biological screening of some new novel indole derivatives

Mehta,Sikotra,Shah

, p. 2594 - 2597 (2007/10/03)

Synthesis of some novel indole derivatives has been undertaken by the reaction of 1,4-benzoquinone with ethyl-β-(arylamino)-crotonates in the presence/absence of nitrogen atmosphere. The products 1a-o have been screened for their antimicrobial activity an

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