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35620-72-5,MFCD00052110
Catalog No.:AA00I6ZR

35620-72-5 | 2-(Phenylthio)nicotinic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$36.00   $25.00
- +
1g
97%
in stock  
$89.00   $62.00
- +
5g
97%
in stock  
$218.00   $153.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I6ZR
Chemical Name:
2-(Phenylthio)nicotinic acid
CAS Number:
35620-72-5
Molecular Formula:
C12H9NO2S
Molecular Weight:
231.2704
MDL Number:
MFCD00052110
SMILES:
OC(=O)c1cccnc1Sc1ccccc1
Properties
Computed Properties
 
Complexity:
241  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.8  

Downstream Synthesis Route

[1]Li,Zhenghua;Xiao,Shangyou;Liang,Ronghui;Xia,Zhining[ResearchonChemicalIntermediates,2012,vol.38,#7,p.1691-1697]

[2]Mann;Reid[JournaloftheChemicalSociety,1952,p.2057,2060]

[1]Locationinpatent:experimentalpartLi,Jie;Jin,Can;Su,Weike[Heterocycles,2010,vol.81,#11,p.2555-2567]

[2]Mann;Reid[JournaloftheChemicalSociety,1952,p.2057,2060]

35620-72-5    239807-63-7   
<i>N</i>-{2-hydroxy-3-4-(2-isopropoxy-phenyl)-piperazin-1-yl-propyl}-2-phenylsulfanyl-nicotinamide 

[1]Kuo,Gee-Hong;Prouty,Catherine;Murray,WilliamV.;Pulito,Virginia;Jolliffe,Linda;Cheung,Peter;Varga,Sally;Evangelisto,Mary;Shaw,Charles[BioorganicandMedicinalChemistry,2000,vol.8,#9,p.2263-2275]

[1]Letavic,MichaelA.;Lord,Brian;Bischoff,Francois;Hawryluk,NatalieA.;Pieters,Serge;Rech,JasonC.;Sales,Zachary;Velter,AdrianaI.;Ao,Hong;Bonaventure,Pascal;Contreras,Victor;Jiang,Xiaohui;Morton,KirstenL.;Scott,Brian;Wang,Qi;Wickenden,AlanD.;Carruthers,NicholasI.;Bhattacharya,Anindya[ACSMedicinalChemistryLetters,2013,vol.4,#4,p.419-422]

[1]Letavic,MichaelA.;Lord,Brian;Bischoff,Francois;Hawryluk,NatalieA.;Pieters,Serge;Rech,JasonC.;Sales,Zachary;Velter,AdrianaI.;Ao,Hong;Bonaventure,Pascal;Contreras,Victor;Jiang,Xiaohui;Morton,KirstenL.;Scott,Brian;Wang,Qi;Wickenden,AlanD.;Carruthers,NicholasI.;Bhattacharya,Anindya[ACSMedicinalChemistryLetters,2013,vol.4,#4,p.419-422]

Literature

Title: 2-(Phenyl-sulfan-yl)pyridine-3-carboxylic acid.

Journal: Acta crystallographica. Section E, Structure reports online 20091101

Title: 5H-1-Benzothio-pyrano[2,3-b]pyridin-5-one.

Journal: Acta crystallographica. Section E, Structure reports online 20080901

Title: 7-Nitro-5H-1-benzothio-pyrano[2,3-b]pyridin-5-one.

Journal: Acta crystallographica. Section E, Structure reports online 20080401

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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