Home Deuterated Building Blocks 168425-64-7
168425-64-7,MFCD10568147
Catalog No.:AA001XYY

168425-64-7 | Compound 401

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1mg
98+%
in stock  
$6.00   $4.00
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5mg
98+%
in stock  
$11.00   $8.00
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10mg
98+%
in stock  
$15.00   $11.00
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25mg
98+%
in stock  
$24.00   $17.00
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50mg
98+%
in stock  
$39.00   $28.00
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100mg
98+%
in stock  
$65.00   $46.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001XYY
Chemical Name:
Compound 401
CAS Number:
168425-64-7
Molecular Formula:
C16H15N3O2
Molecular Weight:
281.3092
MDL Number:
MFCD10568147
SMILES:
O=c1cc(nc2n1ccc1c2cccc1)N1CCOCC1
Properties
Computed Properties
 
Complexity:
532  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
1  
XLogP3:
1.2  

Downstream Synthesis Route

[1]DiBraccio;Roma;Leoncini[EuropeanJournalofMedicinalChemistry,1995,vol.30,#1,p.27-38]

[2]Griffin,RogerJ.;Fontana,Gabriele;Golding,BernardT.;Guiard,Sophie;Hardcastle,IanR.;Leahy,JustinJ.J.;Martin,Niall;Richardson,Caroline;Rigoreau,Laurent;Stockley,Martin;Smith,GraemeC.M.[JournalofMedicinalChemistry,2005,vol.48,#2,p.569-585]

1532-84-9   
CASUnavailable 
  168425-64-7    168425-48-7 

[1]DiBraccio;Roma;Leoncini[EuropeanJournalofMedicinalChemistry,1995,vol.30,#1,p.27-38]

[1]Baradarani,Mehdi;Prager,RolfH.;Schafer,Karl[AustralianJournalofChemistry,1996,vol.49,#8,p.911-916]

[1]Baradarani,MehdiM.;Clark,Adrian;Prager,RolfH.[AustralianJournalofChemistry,1998,vol.51,#6,p.491-498]

[1]Griffin,RogerJ.;Fontana,Gabriele;Golding,BernardT.;Guiard,Sophie;Hardcastle,IanR.;Leahy,JustinJ.J.;Martin,Niall;Richardson,Caroline;Rigoreau,Laurent;Stockley,Martin;Smith,GraemeC.M.[JournalofMedicinalChemistry,2005,vol.48,#2,p.569-585]

Literature

Title: DNA-dependent protein kinase (DNA-PK) inhibitors. Synthesis and biological activity of quinolin-4-one and pyridopyrimidin-4-one surrogates for the chromen-4-one chemotype.

Journal: Journal of medicinal chemistry 20101223

Title: Inhibition of mammalian target of rapamycin signaling by 2-(morpholin-1-yl)pyrimido[2,1-alpha]isoquinolin-4-one.

Journal: The Journal of biological chemistry 20070817

Title: Selective benzopyranone and pyrimido[2,1-a]isoquinolin-4-one inhibitors of DNA-dependent protein kinase: synthesis, structure-activity studies, and radiosensitization of a human tumor cell line in vitro.

Journal: Journal of medicinal chemistry 20050127

Title: Purification and some properties of ATP: arginine phosphotransferase from sea anemones, Condylactis aurantiaca.

Journal: Comparative biochemistry and physiology. B, Comparative biochemistry 19751215

Title: Ballou LM, et al. Inhibition of mammalian target of rapamycin signaling by 2-(morpholin-1-yl)pyrimido,1-alphaisoquinolin-4-one. J Biol Chem. 2007 Aug 17;282(33):24463-70.

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SDS
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