Home Pyridines 74270-78-3
74270-78-3,MFCD02316677
Catalog No.:AA005CNX

74270-78-3 | 4-Benzyl-5-pyridin-4-yl-4h-[1,2,4]triazole-3-thiol

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Purity
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250mg
97%
1 week  
$115.00   $81.00
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1g
97%
1 week  
$306.00   $215.00
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5g
97%
1 week  
$1,069.00   $748.00
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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:
AA005CNX
Chemical Name:
4-Benzyl-5-pyridin-4-yl-4h-[1,2,4]triazole-3-thiol
CAS Number:
74270-78-3
Molecular Formula:
C14H12N4S
Molecular Weight:
268.3369
MDL Number:
MFCD02316677
SMILES:
S=c1[nH]nc(n1Cc1ccccc1)c1ccncc1
Properties
Properties
 
Form:
Solid  

Computed Properties
 
Complexity:
357  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.1  

Downstream Synthesis Route

[1]Habib;Khalil[ArchivderPharmazie,1990,vol.323,#7,p.401-404]

[1]Pancechowsak-Ksepko;Foks;Janowiec;Zwolska-Kwiek[Actapoloniaepharmaceutica,1993,vol.50,#2-3,p.259-267]

[1]Zamani,Khosrow;Bagheri,Shirindokht[Phosphorus,SulfurandSiliconandtheRelatedElements,2006,vol.181,#8,p.1913-1918]

[2]Ahmad,Roshan;Iqbal,Rashid;Akhtar,Humaira;Duddeck,Helmut;Stefaniak,Lech;Sitkowski,Jerzy[Nucleosides,nucleotidesandnucleicacids,2001,vol.20,#9,p.1671-1682]

[3]Liu,Man-Yun;Shi,De-Qing[JournalofHeterocyclicChemistry,2014,vol.51,#SUPPL.1,p.E335-E339]

[1]Ahmad,Roshan;Iqbal,Rashid;Akhtar,Humaira;Duddeck,Helmut;Stefaniak,Lech;Sitkowski,Jerzy[Nucleosides,nucleotidesandnucleicacids,2001,vol.20,#9,p.1671-1682]

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

Title: Synthesis and structure elucidation of some new thioether derivatives of 1,2,4-triazoline-3-thiones and their antimicrobial activities.

Journal: Farmaco (Societa chimica italiana : 1989) 20011201

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Tags:74270-78-3 Molecular Formula|74270-78-3 MDL|74270-78-3 SMILES|74270-78-3 4-Benzyl-5-pyridin-4-yl-4h-[1,2,4]triazole-3-thiol