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29527-27-3,MFCD01761095
Catalog No.:AA00C1ZH

29527-27-3 | 5-(4-Chlorophenyl)-4-methyl-4h-1,2,4-triazole-3-thiol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
1 week  
$180.00   $126.00
- +
500mg
>97%
1 week  
$339.00   $238.00
- +
1g
>97%
1 week  
$464.00   $325.00
- +
5g
>97%
1 week  
$1,212.00   $848.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00C1ZH
Chemical Name:
5-(4-Chlorophenyl)-4-methyl-4h-1,2,4-triazole-3-thiol
CAS Number:
29527-27-3
Molecular Formula:
C9H8ClN3S
Molecular Weight:
225.6979
MDL Number:
MFCD01761095
SMILES:
Clc1ccc(cc1)c1nnc(n1C)S
Properties
Computed Properties
 
Complexity:
271  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.3  

Literature

Title: Novel indoleamine 2,3-dioxygenase-1 inhibitors from a multistep in silico screen.

Journal: Bioorganic & medicinal chemistry 20120201

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SDS
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Tags:29527-27-3 Molecular Formula|29527-27-3 MDL|29527-27-3 SMILES|29527-27-3 5-(4-Chlorophenyl)-4-methyl-4h-1,2,4-triazole-3-thiol