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5959-79-5,MFCD00023055
Catalog No.:AA00EFIR

5959-79-5 | (S)-2-(1,3-Dioxoisoindolin-2-yl)-3-(1H-imidazol-4-yl)propanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$186.00   $130.00
- +
100mg
95%
3 weeks  
$222.00   $155.00
- +
250mg
95%
3 weeks  
$267.00   $187.00
- +
500mg
95%
3 weeks  
$352.00   $247.00
- +
1g
95%
3 weeks  
$420.00   $294.00
- +
2.5g
95%
3 weeks  
$513.00   $359.00
- +
5g
95%
3 weeks  
$665.00   $465.00
- +
10g
95%
3 weeks  
$852.00   $597.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00EFIR
Chemical Name:
(S)-2-(1,3-Dioxoisoindolin-2-yl)-3-(1H-imidazol-4-yl)propanoic acid
CAS Number:
5959-79-5
Molecular Formula:
C14H11N3O4
Molecular Weight:
285.2548
MDL Number:
MFCD00023055
SMILES:
OC(=O)C(N1C(=O)c2c(C1=O)cccc2)Cc1c[nH]cn1
NSC Number:
93967
Properties
Computed Properties
 
Complexity:
443  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.7  

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: Virtual screening approaches for the identification of non-lipid autotaxin inhibitors.

Journal: Bioorganic & medicinal chemistry 20080215

Title: Identification of non-phosphate-containing small molecular weight inhibitors of the tyrosine kinase p56 Lck SH2 domain via in silico screening against the pY + 3 binding site.

Journal: Journal of medicinal chemistry 20040701

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SDS
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Tags:5959-79-5 Molecular Formula|5959-79-5 MDL|5959-79-5 SMILES|5959-79-5 (S)-2-(1,3-Dioxoisoindolin-2-yl)-3-(1H-imidazol-4-yl)propanoic acid