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Home Pyridines 82145-80-0
82145-80-0,MFCD01460018
Catalog No.:AA005A1K

82145-80-0 | 4-[(Pyridin-2-ylthio)methyl]benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$81.00   $57.00
- +
5g
95%
in stock  
$321.00   $225.00
- +
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Technical Information
Catalog Number:
AA005A1K
Chemical Name:
4-[(Pyridin-2-ylthio)methyl]benzoic acid
CAS Number:
82145-80-0
Molecular Formula:
C13H11NO2S
Molecular Weight:
245.2969
MDL Number:
MFCD01460018
SMILES:
OC(=O)c1ccc(cc1)CSc1ccccn1
Properties
Computed Properties
 
Complexity:
252  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2.7  

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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Tags:82145-80-0 Molecular Formula|82145-80-0 MDL|82145-80-0 SMILES|82145-80-0 4-[(Pyridin-2-ylthio)methyl]benzoic acid