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1290541-46-6,MFCD03294274
Catalog No.:AA00A1E2

1290541-46-6 | RAD51 inhibitor B02

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$18.00   $13.00
- +
5mg
98%
in stock  
$44.00   $31.00
- +
10mg
98%
in stock  
$57.00   $40.00
- +
25mg
98%
in stock  
$75.00   $53.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00A1E2
Chemical Name:
RAD51 inhibitor B02
CAS Number:
1290541-46-6
Molecular Formula:
C22H17N3O
Molecular Weight:
339.3899
MDL Number:
MFCD03294274
SMILES:
O=c1n(Cc2ccccc2)c(/C=C/c2cccnc2)nc2c1cccc2
Properties
Computed Properties
 
Complexity:
550  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
4  
XLogP3:
3.4  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2017,vol.27,#14,p.3096-3100

[1]BioorganicandMedicinalChemistryLetters,2017,vol.27,#14,p.3096-3100

Literature

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

Title: Huang F, et al. Identification of specific inhibitors of human RAD51 recombinase using high-throughput screening. ACS Chem Biol. 2011 Jun 17;6(6):628-35.

Title: Huang F, et al. A small molecule inhibitor of human RAD51 potentiates breast cancer cell killing by therapeutic agents in mouse xenografts. PLoS One. 2014 Jun 27;9(6):e100993.

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SDS
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