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27106-14-5,MFCD00052247
Catalog No.:AA00BF90

27106-14-5 | 5-(2-Furyl)-4-methyl-4h-1,2,4-triazole-3-thiol

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Purity
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Price(USD)
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1g
95%
in stock  
$324.00   $227.00
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5g
95%
in stock  
$1,293.00   $905.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BF90
Chemical Name:
5-(2-Furyl)-4-methyl-4h-1,2,4-triazole-3-thiol
CAS Number:
27106-14-5
Molecular Formula:
C7H7N3OS
Molecular Weight:
181.2150
MDL Number:
MFCD00052247
SMILES:
Cn1c(S)nnc1c1ccco1
Properties
Properties
 
Form:
Solid  

Computed Properties
 
Complexity:
241  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1  

Downstream Synthesis Route

[1]Benjamin;SnyderJr.[JournalofHeterocyclicChemistry,1976,vol.13,#5,p.1115-1118]

[1]Benjamin;SnyderJr.[JournalofHeterocyclicChemistry,1976,vol.13,#5,p.1115-1118]

[1]CurrentPatentAssignee:ASTRAZENECAPLC-WO2004/14881,2004,A2Locationinpatent:Page110

[2]Frackenpohl,Jens;Schneider,Linn;Decker,LukaJ.B.;Dittgen,Jan;Fenkl,Franz;Fischer,Christian;Franke,Jana;Freigang,Joerg;Getachew,Rahel;GonzalezFernandez-Nino,SusanaM.;Helmke,Hendrik;Hills,MartinJ.;Hohmann,Sabine;Kleemann,Jochen;Kurowski,Karoline;Lange,Gudrun;Luemmen,Peter;Meyering,Nicole;Poree,Fabien;Schmutzler,Dirk;Wrede,Sebastian[BioorganicandMedicinalChemistry,2019,vol.27,#24]

[1]Micheli,Fabrizio;Bacchi,Alessia;Braggio,Simone;Castelletti,Laura;Cavallini,Palmina;Cavanni,Paolo;Cremonesi,Susanna;DalCin,Michele;Feriani,Aldo;Gehanne,Sylvie;Kajbaf,Mahmud;Marchió,Luciano;Nola,Selena;Oliosi,Beatrice;Pellacani,Annalisa;Perdonà,Elisabetta;Sava,Anna;Semeraro,Teresa;Tarsi,Luca;Tomelleri,Silvia;Wong,Andrea;Visentini,Filippo;Zonzini,Laura;Heidbreder,Christian[JournalofMedicinalChemistry,2016,vol.59,#18,p.8549-8576]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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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SDS
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Tags:27106-14-5 Molecular Formula|27106-14-5 MDL|27106-14-5 SMILES|27106-14-5 5-(2-Furyl)-4-methyl-4h-1,2,4-triazole-3-thiol