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209986-17-4,MFCD04974531
Catalog No.:AA00BE8C

209986-17-4 | γ-Secretase Inhibitor XXI

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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:
AA00BE8C
Chemical Name:
γ-Secretase Inhibitor XXI
CAS Number:
209986-17-4
Molecular Formula:
C27H24F2N4O3
Molecular Weight:
490.5013
MDL Number:
MFCD04974531
SMILES:
Fc1cc(cc(c1)F)CC(=O)N[C@H](C(=O)N[C@H]1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2)C
Properties
Computed Properties
 
Complexity:
837  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
6  
XLogP3:
3.6  

Downstream Synthesis Route
Literature

Title: Recent advances in the identification of gamma-secretase inhibitors to clinically test the Abeta oligomer hypothesis of Alzheimer's disease.

Journal: Journal of medicinal chemistry 20091022

Title: Beher D, et al. Pharmacological knock-down of the presenilin 1 heterodimer by a novel gamma -secretase inhibitor: implications for presenilin biology. J Biol Chem. 2001 Nov 30;276(48):45394-402.

Title: Rasul S, et al. Inhibition of gamma-secretase induces G2/M arrest and triggers apoptosis in breast cancer cells. Br J Cancer. 2009 Jun 16;100(12):1879-88.

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SDS
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