Home Thiazoles 2254-94-6
2254-94-6,MFCD00005817
Catalog No.:AA00BCAB

2254-94-6 | N-METHYLBENZOTHIAZOLE-2-THIONE

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100mg
98%
in stock  
$143.00   $100.00
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250mg
98%
in stock  
$272.00   $190.00
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1g
98%
in stock  
$529.00   $370.00
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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:
AA00BCAB
Chemical Name:
N-METHYLBENZOTHIAZOLE-2-THIONE
CAS Number:
2254-94-6
Molecular Formula:
C8H7NS2
Molecular Weight:
181.2779
MDL Number:
MFCD00005817
SMILES:
CN1C2=CC=CC=C2SC1=S
NSC Number:
66551
Properties
Computed Properties
 
Complexity:
181  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
XLogP3:
2.6  

Downstream Synthesis Route

[1]Stavrovskaya,V.I.;Kolosova,M.O.[JournalofgeneralchemistryoftheUSSR,1960,vol.30,p.711-715][ZhurnalObshcheiKhimii,1960,vol.30,p.689-694]

[1]Zhang,Jing-Lin;Ma,Xiao-Bo[Phosphorus,SulfurandSiliconandtheRelatedElements,1990,vol.53,#1-4,p.15-20]

[1]Stawrowskaja;Kolosowa[ZhurnalObshcheiKhimii,1960,vol.30,p.689,691;engl.Ausg.S.711,712]

[1]Ozturk;Filimonova;Hadjikakou;Kourkoumelis;Dokorou;Manos;Tasiopoulos;Barsan;Butler;Milaeva;Balzarini,Jan;Hadjiliadis[InorganicChemistry,2010,vol.49,#2,p.488-501]

[1]Barnes,NicholasA.;Godfrey,StephenM.;Pritchard,RobinG.;Ratcliffe,Shane[Polyhedron,2010,vol.29,#7,p.1822-1832]

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: Synthesis, structural characterization, and computational studies of novel diiodine adducts with the heterocyclic thioamides N-methylbenzothiazole-2-thione and benzimidazole-2-thione: implications with the mechanism of action of antithyroid drugs.

Journal: Inorganic chemistry 20051114

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SDS
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