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3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one is a complex organic compound with the molecular formula C11H9NO2S2. It is a derivative of the thiazolidonein class of compounds, which are known for their diverse range of biological activities, including potential use as antimicrobial agents. This specific compound features a phenylethyl group attached to the 3-position of the thiazolidinone ring, which contributes to its unique chemical properties. The 2-thioxo group indicates the presence of a carbonyl group (C=O) bonded to a sulfur atom, which is a key structural feature of this molecule. The compound's structure and properties make it a subject of interest in medicinal chemistry and drug design, as it may possess specific pharmacological effects due to its unique arrangement of atoms and functional groups.

3889-20-1

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3889-20-1 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 3889-20-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,8,8 and 9 respectively; the second part has 2 digits, 2 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 3889-20:
(6*3)+(5*8)+(4*8)+(3*9)+(2*2)+(1*0)=121
121 % 10 = 1
So 3889-20-1 is a valid CAS Registry Number.

3889-20-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

1.2 Other means of identification

Product number -
Other names 3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one

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:3889-20-1 SDS

3889-20-1Relevant academic research and scientific papers

Synthesis and biological evaluation of novel rhodanine-based structures with antiviral activity towards HHV-6 virus

Gentili, Valentina,Turrin, Giulia,Marchetti, Paolo,Rizzo, Sabrina,Schiuma, Giovanna,Beltrami, Silvia,Cristofori, Virginia,Illuminati, Davide,Compagnin, Greta,Trapella, Claudio,Rizzo, Roberta,Bortolotti, Daria,Fantinati, Anna

, (2021/12/02)

An increased awareness of diseases associated with Human herpesvirus 6 (HHV-6) infection or reactivation has resulted in a growing interest in the evaluation of the best treatment options available for the clinical management of HHV-6 disease. However, no

Broad-spectrum anti-enveloped virus compound, composition and application thereof

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Paragraph 0077; 0159-0161, (2020/10/20)

The invention relates to a broad-spectrum anti-enveloped virus compound, a composition and an application thereof. The compound comprises a structure as shown in a formula (I) or a pharmaceutically acceptable salt thereof. It is found that the series of c

A concise approach to n-substituted rhodanines through a base-assisted one-pot coupling and cyclization process

Huo, Zhipeng,Liang, Yongxi,Sun, Xun,Tang, Mei-Lin,Zhang, Chenchen

, (2020/03/17)

An efficient approach to obtain functionalized rhodanines was developed through a base-assisted one-pot coupling and continuous cyclization of a primary amine, carbon disulfide, and methyl (2-chloroacetyl)carbamate. This conversion tolerates a broad range of functional groups and can be used to scale the preparation of N-substituted rhodanines in excellent yields.

Thiazolidinone-peptide hybrids as dengue virus protease inhibitors with antiviral activity in cell culture

Nitsche, Christoph,Schreier, Verena N.,Behnam, Mira A. M.,Kumar, Anil,Bartenschlager, Ralf,Klein, Christian D.

, p. 8389 - 8403 (2013/12/04)

The protease of dengue virus is a promising target for antiviral drug discovery. We here report a new generation of peptide-hybrid inhibitors of dengue protease that incorporate N-substituted 5-arylidenethiazolidinone heterocycles (rhodanines and thiazolidinediones) as N-terminal capping groups of the peptide moiety. The compounds were extensively characterized with respect to inhibition of various proteases, inhibition mechanisms, membrane permeability, antiviral activity, and cytotoxicity in cell culture. A sulfur/oxygen exchange in position 2 of the capping heterocycle (thiazolidinedione-capped vs rhodanine-capped peptide hybrids) has a significant effect on these properties and activities. The most promising in vitro affinities were observed for thiazolidinedione-based peptide hybrids containing hydrophobic groups with Ki values between 1.5 and 1.8 μM and competitive inhibition mechanisms. Rhodanine-capped peptide hybrids with hydrophobic substituents have, in correlation with their membrane permeability, a more pronounced antiviral activity in cell culture than the thiazolidinediones.

Small molecule fusion inhibitors: Design, synthesis and biological evaluation of (Z)-3-(5-(3-benzyl-4-oxo-2-thioxothiazolidinylidene)methyl)-N-(3- carboxy-4-hydroxy)phenyl-2,5-dimethylpyrroles and related derivatives targeting HIV-1 gp41

He, Xiao-Yang,Lu, Lu,Qiu, Jiayin,Zou, Peng,Yu, Fei,Jiang, Xing-Kai,Li, Lin,Jiang, Shibo,Liu, Shuwen,Xie, Lan

, p. 7539 - 7548 (2013/11/19)

By a scaffold elongation strategy, a series of (Z)-3-(5-(3-benzyl-4-oxo-2- thioxothiazolidinylidene)methyl)-N-(3-carboxy-4-hydroxy)phenyl-2, 5-dimethylpyrroles and related derivatives with a linear multi-aromatic-ring skeleton were designed, synthesized, and evaluated in HIV-1 gp41 and cellular assays. Among them, the most active compounds, 12e, 12g, and 12k with a one-carbon linker (n = 1) between the rhodanine (C) and phenyl (D) rings, exhibited very promising inhibitory potency with IC50 values of 1.8-2.6 μM and EC50 values of 0.3-1.5 μM against gp41 6-HB formation and HIV-1 replication in MT-2 cells, respectively. Additionally, they were almost equally effective against both T20-sensitive and resistant strains. The related SAR studies and molecular modeling results provided potential for further developing a new class of non-peptide small molecular fusion inhibitors targeting the HIV-1 gp41.

Aqueous microwave-assisted one-pot synthesis of N-substituted rhodanines

Nitsche, Christoph,Klein, Christian D.

, p. 5197 - 5201 (2012/10/30)

Two aqueous, one-pot, microwave-assisted methods for the rapid synthesis of N-substituted rhodanines from amine substrates are described. Alkyl- and benzylamines could be converted into the corresponding rhodanines with an atom-efficient one-pot, three-step protocol based on carbon disulfide and chloroacetic acid in short reaction times and good to excellent yields. An alternative, microwave-assisted one-pot, one-step protocol using bis(carboxymethyl)trithiocarbonate in water was developed for the synthesis of N-arylrhodanines from anilines.

Design, synthesis and biological evaluation of 3-substituted 2,5-dimethyl-N-(3-(1H-tetrazol-5-yl)phenyl)pyrroles as novel potential HIV-1 gp41 inhibitors

He, Xiao-Yang,Zou, Peng,Qiu, Jiayin,Hou, Ling,Jiang, Shibo,Liu, Shuwen,Xie, Lan

experimental part, p. 6726 - 6734 (2011/12/04)

Based on the structure of HIV-1 gp41 binding site for small-molecule inhibitors, optimization of lead 2 resulted in the discovery of a new series of 2,5-dimethyl-3-(5-(N-phenylrhodaninyl)methylene)-N-(3-(1H-tetrazol-5-yl)phenyl) pyrrole compounds with improved anti-HIV-1 activity. The most active compounds 13a and 13j exhibited significant potency against gp41 6-HB formation with IC50 values of 4.4 and 4.6 μM and against HIV-1 replication in the MT-2 cells with EC50 values of 3.2 and 2.2 μM, respectively, thus providing a new starting point to develop highly potent small-molecule HIV fusion inhibitors targeting gp41.

Practical one-pot two-step protocol for the microwave-assisted synthesis of highly functionalized rhodanine derivatives

Radi, Marco,Botta, Lorenzo,Casaluce, Gianni,Bernardini, Martina,Botta, Maurizio

experimental part, p. 200 - 205 (2010/10/19)

A fast and efficient protocol for the generation of substituted 5-arylidene rhodanines in a sequential one-pot two-step process combining the "Holmberg method" and the Knoevenagel condensation under microwaveassisted conditions has been developed. The final compounds 11a-k have been obtained in high yield and purity after a simple precipitation from, methanol, making this procedure facile, practical, and rapid to execute.

Design, synthesis, and structure-activity relationship of a novel series of 2-aryl 5-(4-oxo-3-phenethyl-2-thioxothiazolidinylidenemethyl)furans as HIV-1 entry inhibitors

Katritzky, Alan R.,Tala, Srinivasa R.,Lu, Hong,Vakulenko, Anatoliy V.,Chen, Qi-Yin,Sivapackiam, Jothilingam,Pandya, Keyur,Jiang, Shibo,Debnath, Asim K.

supporting information; experimental part, p. 7631 - 7639 (2010/09/03)

We previously identified two small molecules targeting the HIV-1 gp41, N-(4-carboxy-3-hydroxy)phenyl-2,5-dimethylpyrrole 12 (NB-2) and N-(3-carboxy-4-chloro)phenylpyrrole 13 (NB-64), that inhibit HIV-1 infection at low micromolar levels. On the basis of m

USE OF THIAZOLIDINONE DERIVATIVES AS ANTIANGIOGENIC AGENTS

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Page/Page column 14; 15, (2008/06/13)

The invention relates to the use of compounds of general formula (I), in which R1, R2 and X are as defined in the description for the preparation of pharmaceutical compositions for the treatment of pathologies in which inhibition of the interaction between HIF-1α and p300 is beneficial, in particular as antiangiogenic medicaments for the therapy of solid tumors.

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