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2-CHLOROMETHYL-5-PHENYL-3H-THIENO[2,3-D]PYRIMIDIN-4-ONE is a heterocyclic organic compound characterized by a molecular formula C13H9ClN2OS. It features a thiophene ring fused to a pyrimidine ring, with a chloromethyl group at the 2-position and a phenyl group at the 5-position of the pyrimidine ring. This unique structure endows it with potential bioactive properties and makes it a promising candidate for drug development.

89567-07-7

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89567-07-7 Usage

Uses

Used in Pharmaceutical Industry:
2-CHLOROMETHYL-5-PHENYL-3H-THIENO[2,3-D]PYRIMIDIN-4-ONE is used as a key intermediate in the synthesis of potential drug candidates due to its unique chemical structure and potential bioactive properties. Its ability to exhibit a range of pharmacological activities, such as antimicrobial, antifungal, and antiviral properties, makes it a valuable compound for the development of new therapeutic agents.
Used in Agricultural Chemicals:
2-CHLOROMETHYL-5-PHENYL-3H-THIENO[2,3-D]PYRIMIDIN-4-ONE may also have potential applications in the field of agricultural chemicals. Its bioactive properties could be harnessed to develop new pesticides or fungicides, contributing to more effective and sustainable agricultural practices.

Check Digit Verification of cas no

The CAS Registry Mumber 89567-07-7 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,9,5,6 and 7 respectively; the second part has 2 digits, 0 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 89567-07:
(7*8)+(6*9)+(5*5)+(4*6)+(3*7)+(2*0)+(1*7)=187
187 % 10 = 7
So 89567-07-7 is a valid CAS Registry Number.
InChI:InChI=1/C13H9ClN2OS/c14-6-10-15-12(17)11-9(7-18-13(11)16-10)8-4-2-1-3-5-8/h1-5,7H,6H2,(H,15,16,17)

89567-07-7SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(chloromethyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

1.2 Other means of identification

Product number -
Other names 3-(chloromethyl)-7-phenyl-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-5-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:89567-07-7 SDS

89567-07-7Relevant academic research and scientific papers

A Thieno[2,3- d]pyrimidine Scaffold Is a Novel Negative Allosteric Modulator of the Dopamine D2 Receptor

Fyfe, Tim J.,Zarzycka, Barbara,Lim, Herman D.,Kellam, Barrie,Mistry, Shailesh N.,Katrich, Vsevolod,Scammells, Peter J.,Lane, J. Robert,Capuano, Ben

, p. 174 - 206 (2018/05/14)

Recently, a novel negative allosteric modulator (NAM) of the D2-like dopamine receptors 1 was identified through virtual ligand screening. This ligand comprises a thieno[2,3-d]pyrimidine scaffold that does not feature in known dopaminergic ligands. Herein, we provide pharmacological validation of an allosteric mode of action for 1, revealing that it is a NAM of dopamine efficacy and identify the structural determinants of this allostery. We find that key structural moieties are important for functional affinity and negative cooperativity, while functionalization of the thienopyrimidine at the 5- and 6-positions results in analogues with divergent cooperativity profiles. Successive compound iterations have yielded analogues exhibiting a 10-fold improvement in functional affinity, as well as enhanced negative cooperativity with dopamine affinity and efficacy. Furthermore, our study reveals a fragment-like core that maintains low μM affinity and robust negative cooperativity with markedly improved ligand efficiency.

Synthesis and biological evaluation of novel condensed pyrimidinylmethylsulfinylbenzimidazoles as antiulcer agent

Dudhe, Prashik B.,Jain, Kishor S.,Raskar, Vikas K.,Deodhe, Atul S.,Patel, Jasminkumar G.,Phoujdar, Manisha S.,Kathiravan, Muthu K.

, p. 3719 - 3727 (2013/07/26)

Current therapies to treat gastroesophageal reflux disease (GERD), peptic ulcer disease (PUD), and other acid-related diseases either prevent stimulation of the parietal cell (H2-receptor antagonists) or inhibit gastric H+/K+/s

A novel microwave-assisted green synthesis of condensed 2-substituted-pyrimidin-4(3H)-ones under solvent-free conditions

Jain, Kishor S.,Bariwal, Jitender B.,Phoujdar, Manisha S.,Nagras, Madhuri A.,Amrutkar, Rakesh D.,Munde, Manoj K.,Tamboli, Riyaj S.,Khedkar, Samrat A.,Khiste, Rahul H.,Vidyasagar, Nikhil C.,Dabholkar, Vinit V.,Kathiravan

body text, p. 178 - 185 (2009/07/19)

A rapid microwave-assisted green chemical synthesis of condensed 2-substituted-pyrimidin-4(3H)-ones 3, 4, and 5 involving the condensation of a variety of nitriles with o-aminoesters of thiophene 2a-e, benzene 2f, dimethoxybenzene 2g and quinazolinone 2h in the presence of catalytic amount of HCl alone or with the Lewis acid AlCl3 under solvent-free conditions, is described for the first time. This novel and clean one-pot methodology, which is characterized by very short reaction times and easy workup procedures, can be exploited to generate a diverse library of condensed pyrimidine heterocycles.

Synthesis and antihyperlipidemic activity of some novel condensed 2-chloroalkyl-4-chloro/hydroxy-5,6-disubstituted pyrimidines

Kathiravan, Matthu K.,Shishoo, Chamanlal J.,Kumar, Krishnan Girish,Roy, Saroj Kumar,Mahadik, Kakasheb R.,Kadam, Shivajirao S.,Jain, Kishor S.

, p. 599 - 606 (2008/03/13)

Synthesis and antihyperlipidemic activity of a series of novel condensed 2-chloroalkyl-4-chloro/hydroxy-5,6-di-substituted pyrimidines are described. The design of these compounds is based on the earlier QSAR study on the antihyperlipidemic 2-substituted

THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS

-

Page 55, (2008/06/13)

The present invention provides thienopyrimidine compounds which are potasium channels inhibitors. Pharmaceutical compositions comprising the compounds and their use in the treatment of arrhythmia are also provided.

Synthesis and pharmacological study of antihyperlipaemic activity of 2-substituted thieno(2,3-d)pyrimidin-4(3H)-ones

Shishoo,Devani,Bhadti,Jain,Rathod,Goyal,Gandhi,Patel,Naik

, p. 567 - 572 (2007/10/02)

A series of 2-substituted thieno(2,3-d)pyrimidin-4-(3H)-ones (1-15) was prepared by the reaction of thiophene ortho-aminoester (IV) with a variety of nitriles (V) under acidic conditions, and screened for antihyperlipaemic activity in various and animals

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