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299921-16-7,MFCD01870963
Catalog No.:AA00I5I8

299921-16-7 | 4-Benzyl-5-(3,4-dimethoxyphenyl)-4h-1,2,4-triazole-3-thiol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500mg
>95%
2 weeks  
$552.00   $386.00
- +
1g
>95%
2 weeks  
$582.00   $408.00
- +
5g
>95%
2 weeks  
$898.00   $629.00
- +
10g
>95%
2 weeks  
$1,286.00   $900.00
- +
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00I5I8
Chemical Name:
4-Benzyl-5-(3,4-dimethoxyphenyl)-4h-1,2,4-triazole-3-thiol
CAS Number:
299921-16-7
Molecular Formula:
C17H17N3O2S
Molecular Weight:
327.4008
MDL Number:
MFCD01870963
SMILES:
COc1cc(ccc1OC)c1n[nH]c(=S)n1Cc1ccccc1
Properties
Computed Properties
 
Complexity:
451  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
3.1  

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:299921-16-7 Molecular Formula|299921-16-7 MDL|299921-16-7 SMILES|299921-16-7 4-Benzyl-5-(3,4-dimethoxyphenyl)-4h-1,2,4-triazole-3-thiol