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1307245-87-9
Catalog No.:AA01FSI2

1307245-87-9 | LY-2940094 tartrate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98+%
in stock  
$76.00   $54.00
- +
25mg
98+%
in stock  
$519.00   $363.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA01FSI2
Chemical Name:
LY-2940094 tartrate
CAS Number:
1307245-87-9
Molecular Formula:
C26H29ClF2N4O8S
Molecular Weight:
631.0453
SMILES:
OC(=O)[C@@H]([C@H](C(=O)O)O)O.OCc1cccnc1n1nc(c(c1)CN1CCC2(CC1)OCC(c1c2sc(c1)Cl)(F)F)C
Properties
Computed Properties
 
Complexity:
806  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
42  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
5  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
2  

Downstream Synthesis Route

[1]Toledo,MiguelA.;Pedregal,Concepción;Lafuente,Celia;Diaz,Nuria;Martinez-Grau,MariaAngeles;Jiménez,Alma;Benito,Ana;Torrado,Alicia;Mateos,Carlos;Joshi,ElizabethM.;Kahl,StevenD.;Rash,KarenS.;Mudra,DanielR.;Barth,VanessaN.;Shaw,DavidB.;McKinzie,David;Witkin,JeffreyM.;Statnick,MichaelA.[JournalofMedicinalChemistry,2014,vol.57,#8,p.3418-3429]

[1]Toledo,MiguelA.;Pedregal,Concepción;Lafuente,Celia;Diaz,Nuria;Martinez-Grau,MariaAngeles;Jiménez,Alma;Benito,Ana;Torrado,Alicia;Mateos,Carlos;Joshi,ElizabethM.;Kahl,StevenD.;Rash,KarenS.;Mudra,DanielR.;Barth,VanessaN.;Shaw,DavidB.;McKinzie,David;Witkin,JeffreyM.;Statnick,MichaelA.[JournalofMedicinalChemistry,2014,vol.57,#8,p.3418-3429]

[1]Toledo,MiguelA.;Pedregal,Concepción;Lafuente,Celia;Diaz,Nuria;Martinez-Grau,MariaAngeles;Jiménez,Alma;Benito,Ana;Torrado,Alicia;Mateos,Carlos;Joshi,ElizabethM.;Kahl,StevenD.;Rash,KarenS.;Mudra,DanielR.;Barth,VanessaN.;Shaw,DavidB.;McKinzie,David;Witkin,JeffreyM.;Statnick,MichaelA.[JournalofMedicinalChemistry,2014,vol.57,#8,p.3418-3429]

[1]Toledo,MiguelA.;Pedregal,Concepción;Lafuente,Celia;Diaz,Nuria;Martinez-Grau,MariaAngeles;Jiménez,Alma;Benito,Ana;Torrado,Alicia;Mateos,Carlos;Joshi,ElizabethM.;Kahl,StevenD.;Rash,KarenS.;Mudra,DanielR.;Barth,VanessaN.;Shaw,DavidB.;McKinzie,David;Witkin,JeffreyM.;Statnick,MichaelA.[JournalofMedicinalChemistry,2014,vol.57,#8,p.3418-3429]

[1]Toledo,MiguelA.;Pedregal,Concepción;Lafuente,Celia;Diaz,Nuria;Martinez-Grau,MariaAngeles;Jiménez,Alma;Benito,Ana;Torrado,Alicia;Mateos,Carlos;Joshi,ElizabethM.;Kahl,StevenD.;Rash,KarenS.;Mudra,DanielR.;Barth,VanessaN.;Shaw,DavidB.;McKinzie,David;Witkin,JeffreyM.;Statnick,MichaelA.[JournalofMedicinalChemistry,2014,vol.57,#8,p.3418-3429]

Literature

Title: Rorick-Kehn LM, et al. A Novel, Orally Bioavailable Nociceptin Receptor Antagonist, LY2940094, Reduces Ethanol Self-Administration and Ethanol Seeking in Animal Models. Alcohol Clin Exp Res. 2016 May;40(5):945-54.

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SDS
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