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5134-62-3,MFCD00724055
Catalog No.:AA00D8KH

5134-62-3 | 1-(Toluene-4-sulfonyl)-piperidine-3-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$274.00   $192.00
- +
5g
95%
in stock  
$724.00   $507.00
- +
25g
95%
in stock  
$2,070.00   $1,449.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00D8KH
Chemical Name:
1-(Toluene-4-sulfonyl)-piperidine-3-carboxylic acid
CAS Number:
5134-62-3
Molecular Formula:
C13H17NO4S
Molecular Weight:
283.3434
MDL Number:
MFCD00724055
SMILES:
OC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)C
Properties
Computed Properties
 
Complexity:
420  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.5  

Downstream Synthesis Route
85342-65-0    5134-62-3   
C21H16Cl4N2O6S 

[1]Nature,2017,vol.545,p.213-218

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:5134-62-3 Molecular Formula|5134-62-3 MDL|5134-62-3 SMILES|5134-62-3 1-(Toluene-4-sulfonyl)-piperidine-3-carboxylic acid