Home Other Building Blocks 1197196-48-7
1197196-48-7,MFCD18251564
Catalog No.:AA008SPZ

1197196-48-7 | UNC0224

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$25.00   $18.00
- +
5mg
98%
in stock  
$86.00   $61.00
- +
10mg
98%
in stock  
$130.00   $91.00
- +
25mg
98%
in stock  
$217.00   $152.00
- +
50mg
98%
in stock  
$367.00   $257.00
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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:
AA008SPZ
Chemical Name:
UNC0224
CAS Number:
1197196-48-7
Molecular Formula:
C26H43N7O2
Molecular Weight:
485.6653
MDL Number:
MFCD18251564
SMILES:
COc1cc2c(cc1OCCCN(C)C)nc(nc2NC1CCN(CC1)C)N1CCCN(CC1)C
Properties
Computed Properties
 
Complexity:
619  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
9  
XLogP3:
3.4  

Downstream Synthesis Route

[1]Liu,Feng;Chen,Xin;Allali-Hassani,Abdellah;Quinn,AmyM.;Wasney,GregoryA.;Dong,Aiping;Barsyte,Dalia;Kozieradzki,Ivona;Senisterra,Guillermo;Chau,Irene;Siarheyeva,Alena;Kireev,DmitriB.;Jadhav,Ajit;Herold,J.Martin;Frye,StephenV.;Arrowsmith,CherylH.;Brown,PeterJ.;Simeonov,Anton;Vedadi,Masoud;Jin,Jian[JournalofMedicinalChemistry,2009,vol.52,#24,p.7950-7953]

[2]Locationinpatent:experimentalpartLiu,Feng;Chen,Xin;Allali-Hassani,Abdellah;Quinn,AmyM.;Wigle,TimJ.;Wasney,GregoryA.;Dong,Aiping;Senisterra,Guillermo;Chau,Irene;Siarheyeva,Alena;Norris,JacquelineL.;Kireev,DmitriB.;Jadhav,Ajit;Herold,J.Martin;Janzen,WilliamP.;Arrowsmith,CherylH.;Frye,StephenV.;Brown,PeterJ.;Simeonov,Anton;Vedadi,Masoud;Jin,Jian[JournalofMedicinalChemistry,2010,vol.53,#15,p.5844-5857]

Literature

Title: Oncoepigenomics: making histone lysine methylation count.

Journal: European journal of medicinal chemistry 20121001

Title: Optimization of cellular activity of G9a inhibitors 7-aminoalkoxy-quinazolines.

Journal: Journal of medicinal chemistry 20110908

Title: Protein lysine methyltransferase G9a inhibitors: design, synthesis, and structure activity relationships of 2,4-diamino-7-aminoalkoxy-quinazolines.

Journal: Journal of medicinal chemistry 20100812

Title: Discovery of a 2,4-diamino-7-aminoalkoxyquinazoline as a potent and selective inhibitor of histone lysine methyltransferase G9a.

Journal: Journal of medicinal chemistry 20091224

Title: Liu F, et al. Discovery of a 2,4-diamino-7-aminoalkoxyquinazoline as a potent and selective inhibitor of histone lysine methyltransferase G9a. J Med Chem. 2009 Dec 24;52(24):7950-3.

Title: Liu F, et al. Protein lysine methyltransferase G9a inhibitors: design, synthesis, and structure activity relationships of 2,4-diamino-7-aminoalkoxy-quinazolines. J Med Chem. 2010 Aug 12;53(15):5844-57.

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SDS
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