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53242-68-5,MFCD03036852
Catalog No.:AA00D9G5

53242-68-5 | 2-Chloro-5-(1h-pyrrol-1-yl)benzoic acid

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100mg
95%
in stock  
$234.00   $164.00
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1g
95%
in stock  
$710.00   $497.00
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00D9G5
Chemical Name:
2-Chloro-5-(1h-pyrrol-1-yl)benzoic acid
CAS Number:
53242-68-5
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
MDL Number:
MFCD03036852
SMILES:
OC(=O)c1cc(ccc1Cl)n1cccc1
Properties
Computed Properties
 
Complexity:
241  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.6  

Literature

Title: Small molecule fusion inhibitors: design, synthesis and biological evaluation of (Z)-3-(5-(3-benzyl-4-oxo-2-thioxothiazolidinylidene)methyl)-N-(3-carboxy-4-hydroxy)phenyl-2,5-dimethylpyrroles and related derivatives targeting HIV-1 gp41.

Journal: Bioorganic & medicinal chemistry 20131201

Title: Design, synthesis and biological evaluation of 3-substituted 2,5-dimethyl-N-(3-(1H-tetrazol-5-yl)phenyl)pyrroles as novel potential HIV-1 gp41 inhibitors.

Journal: Bioorganic & medicinal chemistry 20111115

Title: Design, synthesis, and structure-activity relationship of a novel series of 2-aryl 5-(4-oxo-3-phenethyl-2-thioxothiazolidinylidenemethyl)furans as HIV-1 entry inhibitors.

Journal: Journal of medicinal chemistry 20091210

Title: Design, synthesis, and biological evaluation of N-carboxyphenylpyrrole derivatives as potent HIV fusion inhibitors targeting gp41.

Journal: Journal of medicinal chemistry 20081225

Title: Molecular modeling studies of N-substituted pyrrole derivatives--potential HIV-1 gp41 inhibitors.

Journal: Bioorganic & medicinal chemistry 20080315

Title: N-substituted pyrrole derivatives as novel human immunodeficiency virus type 1 entry inhibitors that interfere with the gp41 six-helix bundle formation and block virus fusion.

Journal: Antimicrobial agents and chemotherapy 20041101

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