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174573-98-9,MFCD01163891
Catalog No.:AA0078T6

174573-98-9 | 5-(4-tert-Butylphenyl)-4-ethyl-4h-1,2,4-triazole-3-thiol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500mg
>95%
2 weeks  
$531.00   $372.00
- +
1g
>95%
2 weeks  
$552.00   $386.00
- +
5g
>95%
2 weeks  
$817.00   $572.00
- +
10g
>95%
2 weeks  
$1,000.00   $700.00
- +
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA0078T6
Chemical Name:
5-(4-tert-Butylphenyl)-4-ethyl-4h-1,2,4-triazole-3-thiol
CAS Number:
174573-98-9
Molecular Formula:
C14H19N3S
Molecular Weight:
261.3858
MDL Number:
MFCD01163891
SMILES:
CCn1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C
Properties
Computed Properties
 
Complexity:
349  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
3.7  

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:174573-98-9 Molecular Formula|174573-98-9 MDL|174573-98-9 SMILES|174573-98-9 5-(4-tert-Butylphenyl)-4-ethyl-4h-1,2,4-triazole-3-thiol |Heterocyclic_Building_Blocks