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332898-63-2,MFCD02614443
Catalog No.:AA00C5V7

332898-63-2 | 5-Acetamido-2-(2,5-dimethyl-1H-pyrrol-1-yl)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:
AA00C5V7
Chemical Name:
5-Acetamido-2-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
CAS Number:
332898-63-2
Molecular Formula:
C15H16N2O3
Molecular Weight:
272.2991
MDL Number:
MFCD02614443
SMILES:
CC(=O)Nc1ccc(c(c1)C(=O)O)n1c(C)ccc1C
Properties
Computed Properties
 
Complexity:
375  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
1.8  

Literature

Title: Discovery of Mycobacterium tuberculosis protein tyrosine phosphatase A (MptpA) inhibitors based on natural products and a fragment-based approach.

Journal: Chembiochem : a European journal of chemical biology 20051001

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Tags:332898-63-2 Molecular Formula|332898-63-2 MDL|332898-63-2 SMILES|332898-63-2 5-Acetamido-2-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid