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170746-99-3,MFCD08271835
Catalog No.:AA019PCW

170746-99-3 | 2-(4-benzyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$190.00   $133.00
- +
100mg
95%
3 weeks  
$233.00   $163.00
- +
250mg
95%
3 weeks  
$279.00   $195.00
- +
500mg
95%
3 weeks  
$427.00   $299.00
- +
1g
95%
3 weeks  
$572.00   $400.00
- +
2.5g
95%
3 weeks  
$1,013.00   $709.00
- +
5g
95%
3 weeks  
$1,442.00   $1,009.00
- +
10g
95%
3 weeks  
$2,081.00   $1,457.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA019PCW
Chemical Name:
2-(4-benzyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)acetic acid
CAS Number:
170746-99-3
Molecular Formula:
C11H11N3O2S
Molecular Weight:
249.2889
MDL Number:
MFCD08271835
SMILES:
OC(=O)Cc1nnc(n1Cc1ccccc1)S
Properties
Computed Properties
 
Complexity:
351  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
1.2  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:170746-99-3 Molecular Formula|170746-99-3 MDL|170746-99-3 SMILES|170746-99-3 2-(4-benzyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)acetic acid