Home Other Building Blocks 38942-51-7
38942-51-7,MFCD00662793
Catalog No.:AA007798

38942-51-7 | 4-Methyl-5-phenyl-4h-1,2,4-triazole-3-thiol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$145.00   $102.00
- +
1g
95%
in stock  
$245.00   $172.00
- +
5g
95%
in stock  
$978.00   $685.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA007798
Chemical Name:
4-Methyl-5-phenyl-4h-1,2,4-triazole-3-thiol
CAS Number:
38942-51-7
Molecular Formula:
C9H9N3S
Molecular Weight:
191.2529
MDL Number:
MFCD00662793
SMILES:
Cn1c(S)nnc1c1ccccc1
Properties
Computed Properties
 
Complexity:
243  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.6  

Downstream Synthesis Route

[1]Ivanova,NataliaV.;Sviridov,SergeyI.;Shorshnev,SergeyV.;Stepanov,AleksanderE.[Synthesis,2006,#1,p.156-160]

74367-78-5    38942-51-7   
3-(3,5-dinitrobenzyl)sulfanyl-4-methyl-5-phenyl-4H-1,2,4-triazole 

[1]JournalofMedicinalChemistry,2019,vol.62,p.8115-8139

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
Tags:38942-51-7 Molecular Formula|38942-51-7 MDL|38942-51-7 SMILES|38942-51-7 4-Methyl-5-phenyl-4h-1,2,4-triazole-3-thiol