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Home Other Building Blocks 1430213-30-1
1430213-30-1,MFCD24849400
Catalog No.:AA009CAO

1430213-30-1 | ML216

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$46.00   $32.00
- +
5mg
≥98%
in stock  
$98.00   $68.00
- +
10mg
≥98%
in stock  
$172.00   $120.00
- +
25mg
98%
in stock  
$358.00   $250.00
- +
50mg
95%
in stock  
$412.00   $289.00
- +
500mg
98% by HPLC
in stock  
$2,920.00   $2,044.00
- +
1000mg
98% by HPLC
in stock  
$4,634.00   $3,244.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA009CAO
Chemical Name:
ML216
CAS Number:
1430213-30-1
Molecular Formula:
C15H9F4N5OS
Molecular Weight:
383.3235
MDL Number:
MFCD24849400
SMILES:
O=C(Nc1nnc(s1)c1ccncc1)Nc1ccc(c(c1)C(F)(F)F)F
Properties
Computed Properties
 
Complexity:
491  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
2.8  

Downstream Synthesis Route
2002-04-2   
1-fluoro-4-isocyanato-2-(trifluoromethyl)benzene 
  1430213-30-1 

[1]BioorganicandMedicinalChemistryLetters,2013,vol.23,p.5660-5666

[1]Chen,Xiangrong;Ali,YusufI.;Fisher,CharlotteEL;Arribas-Bosacoma,Raquel;Rajasekaran,MohanB.;Williams,Gareth;Walker,Sarah;Booth,JessicaR.;Hudson,JessicaJR;MarkRoe;Pearl,LaurenceH.;Ward,SimonE.;Pearl,FrancesMG;Oliver,AntonyW.[eLife,2021,vol.10]

phenyl5-(4-pyridyl)-1,3,4-thiadiazol-2-ylcarbamate 
  2357-47-3    1430213-30-1 

[1]Chen,Xiangrong;Ali,YusufI.;Fisher,CharlotteEL;Arribas-Bosacoma,Raquel;Rajasekaran,MohanB.;Williams,Gareth;Walker,Sarah;Booth,JessicaR.;Hudson,JessicaJR;MarkRoe;Pearl,LaurenceH.;Ward,SimonE.;Pearl,FrancesMG;Oliver,AntonyW.[eLife,2021,vol.10]

Literature

Title: Identification of potent Yes1 kinase inhibitors using a library screening approach.

Journal: Bioorganic & medicinal chemistry letters 20130801

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SDS
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