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5-(methylsulfanyl)pyrimidine-2,4(1H,3H)-dione, also known as 5-(methylthio)cytosine, is a chemical compound with the molecular formula C5H6N2O2S. It is a derivative of cytosine, a nucleobase commonly found in DNA and RNA. 5-(methylsulfanyl)pyrimidine-2,4(1H,3H)-dione features a pyrimidine ring with a methylsulfanyl group attached to the 5-carbon position, and ketone groups at the 2 and 4 positions. Its unique structure and properties make it a promising candidate for various applications in pharmaceuticals, organic synthesis, and medicinal chemistry research, as well as a potential mutagen for genetic studies.

16350-59-7

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16350-59-7 Usage

Uses

Used in Pharmaceutical Industry:
5-(methylsulfanyl)pyrimidine-2,4(1H,3H)-dione is used as an active pharmaceutical ingredient for the development of new drugs. Its unique structure and properties may contribute to the discovery of novel therapeutic agents with improved efficacy and selectivity.
Used in Organic Synthesis:
5-(methylsulfanyl)pyrimidine-2,4(1H,3H)-dione serves as a key intermediate in the synthesis of various organic compounds. Its versatile chemical reactivity allows for the preparation of a wide range of derivatives with potential applications in different fields.
Used in Medicinal Chemistry Research:
5-(methylsulfanyl)pyrimidine-2,4(1H,3H)-dione is utilized as a research tool in medicinal chemistry to study the structure-activity relationships of biologically active molecules. Its unique features can provide insights into the design of new drugs with improved pharmacological properties.
Used as a Mutagen in Genetic Studies:
5-(methylsulfanyl)pyrimidine-2,4(1H,3H)-dione is employed as a mutagen to induce mutations in various organisms. This allows researchers to study the effects of genetic alterations on biological processes and develop a better understanding of the molecular mechanisms underlying different diseases and conditions.

Check Digit Verification of cas no

The CAS Registry Mumber 16350-59-7 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,6,3,5 and 0 respectively; the second part has 2 digits, 5 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 16350-59:
(7*1)+(6*6)+(5*3)+(4*5)+(3*0)+(2*5)+(1*9)=97
97 % 10 = 7
So 16350-59-7 is a valid CAS Registry Number.

16350-59-7SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 5-methylsulfanyl-1H-pyrimidine-2,4-dione

1.2 Other means of identification

Product number -
Other names 5-mercaptomethyl-uracil

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:16350-59-7 SDS

16350-59-7Relevant academic research and scientific papers

As tyrosine kinase inhibitors of the nitrogen-containing heteroaromatic ring derivatives

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Paragraph 0369; 0370; 0371; 0372; 0373, (2018/09/02)

The present invention relates to compounds as represented by general formula (I) as tyrosine kinase inhibitors, preparation method thereof, pharmaceutical compositions containing the compounds, and uses thereof for preventing and/or treating instances of B-cell related leukemia, inflammatory diseases and autoimmune diseases, wherein A, ring B, L1, L2, R1, R2, R3, a, b, c, d, e, p and q are as defined in the specification.

MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX

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Page/Page column 127, (2015/06/25)

Monocyclic pyrimidine and pyridine compounds having a benzyl amine substituent at the 4 position and a 5:6 bicyclic heteroaryl substituent at the 2 position of the pyrimidine or pyridine ring as well as optional aliphatic, functional and/or aromatic components substituted at other positions of the ring are disclosed. These compounds are inhibitors of the AAA proteasome complex containing p97 and are effective medicinal agents for treatment of diseases associated with p97 bioactivity such as cancer.

Synthesis and structure-activity relationship studies of N -benzyl-2-phenylpyrimidin-4-amine derivatives as potent usp1/uaf1 deubiquitinase inhibitors with anticancer activity against nonsmall cell lung cancer

Dexheimer, Thomas S.,Rosenthal, Andrew S.,Luci, Diane K.,Liang, Qin,Villamil, Mark A.,Chen, Junjun,Sun, Hongmao,Kerns, Edward H.,Simeonov, Anton,Jadhav, Ajit,Zhuang, Zhihao,Maloney, David J.

supporting information, p. 8099 - 8110 (2014/12/10)

Deregulation of ubiquitin conjugation or deconjugation has been implicated in the pathogenesis of many human diseases including cancer. The deubiquitinating enzyme USP1 (ubiquitin-specific protease 1), in association with UAF1 (USP1-associated factor 1), is a known regulator of DNA damage response and has been shown as a promising anticancer target. To further evaluate USP1/UAF1 as a therapeutic target, we conducted a quantitative high throughput screen of >400000 compounds and subsequent medicinal chemistry optimization of small molecules that inhibit the deubiquitinating activity of USP1/UAF1. Ultimately, these efforts led to the identification of ML323 (70) and related N-benzyl-2-phenylpyrimidin-4-amine derivatives, which possess nanomolar USP1/UAF1 inhibitory potency. Moreover, we demonstrate a strong correlation between compound IC50 values for USP1/UAF1 inhibition and activity in nonsmall cell lung cancer cells, specifically increased monoubiquitinated PCNA (Ub-PCNA) levels and decreased cell survival. Our results establish the druggability of the USP1/UAF1 deubiquitinase complex and its potential as a molecular target for anticancer therapies.

NOVEL PYRIMIDINE COMPOUNDS AS MTOR AND P13K INHIBITORS

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Page/Page column 191, (2011/07/30)

The present invention relates to pyrimidine compounds of formula (I): which are useful in treating mTOR kinase- or PI3K kinase-related diseases.

Functionalization of unprotected uracil derivatives using the halogen - Magnesium exchange

Kopp, Felix,Knoechel, Paul

, p. 1639 - 1641 (2008/02/02)

The reaction of commercially available 5-iodouracil with 2 equiv of MeMgCl in the presence of LiCl, followed by the addition of i-PrMgCl-LiCl, provides the corresponding trimagnesiated species, which reacts with various electrophiles to give selectively 5

Pyrimidine derivatives

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, (2011/04/19)

The present invention relates to trisubstituted pyrimidines of formula (I) 1wherein 0Ra to Re are defined as in claim 1, which are suitable for the treatment of illnesses characterised by excessive or abnormal cell proliferation, the use thereof for preparing a pharmaceutical composition with the abovementioned properties, and processes for the preparation thereof.

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