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1496581-76-0,MFCD28502215
Catalog No.:AA00ABPE

1496581-76-0 | GNE-3511

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98+%
in stock  
$45.00   $32.00
- +
5mg
98+%
in stock  
$112.00   $78.00
- +
10mg
98+%
in stock  
$144.00   $101.00
- +
25mg
98+%
in stock  
$245.00   $171.00
- +
500mg
98% by HPLC
in stock  
$3,958.00   $2,771.00
- +
1000mg
98% by HPLC
in stock  
$6,295.00   $4,407.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00ABPE
Chemical Name:
GNE-3511
CAS Number:
1496581-76-0
Molecular Formula:
C23H26F2N6O
Molecular Weight:
440.4889
MDL Number:
MFCD28502215
SMILES:
N#Cc1ccnc(c1)Nc1cc(cc(n1)N1CCC(C1)(F)F)C1CCN(CC1)C1COC1
Properties
Computed Properties
 
Complexity:
689  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
3.2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/174780,2013,A1

[2]Patel,Snahel;Cohen,Frederick;Dean,BrianJ.;DeLaTorre,Kelly;Deshmukh,Gauri;Estrada,AnthonyA.;Ghosh,ArundhatiSengupta;Gibbons,Paul;Gustafson,Amy;Huestis,MalcolmP.;LePichon,ClaireE.;Lin,Han;Liu,Wendy;Liu,Xingrong;Liu,Yichin;Ly,CuongQ.;Lyssikatos,JosephP.;Ma,Changyou;Scearce-Levie,Kimberly;Shin,YoungG.;Solanoy,Hilda;Stark,KimberlyL.;Wang,Jian;Wang,Bei;Zhao,Xianrui;Lewcock,JosephW.;Siu,Michael[JournalofMedicinalChemistry,2015,vol.58,#1,p.401-418]

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/174780,2013,A1

[2]Patel,Snahel;Cohen,Frederick;Dean,BrianJ.;DeLaTorre,Kelly;Deshmukh,Gauri;Estrada,AnthonyA.;Ghosh,ArundhatiSengupta;Gibbons,Paul;Gustafson,Amy;Huestis,MalcolmP.;LePichon,ClaireE.;Lin,Han;Liu,Wendy;Liu,Xingrong;Liu,Yichin;Ly,CuongQ.;Lyssikatos,JosephP.;Ma,Changyou;Scearce-Levie,Kimberly;Shin,YoungG.;Solanoy,Hilda;Stark,KimberlyL.;Wang,Jian;Wang,Bei;Zhao,Xianrui;Lewcock,JosephW.;Siu,Michael[JournalofMedicinalChemistry,2015,vol.58,#1,p.401-418]

2-chloro-6-(3,3-difluoropyrrolidin-1-yl)-4-(1-(oxetan-3-yl)-piperidin-4-yl)pyridine 
  42182-27-4   
2-((6-(3,3-difluoropyrrolidin-1-yl)-4-(1-(oxetan-3-yl)-piperidin-4-yl)pyridin-2-yl)amino)isonicotinonitrile 

[1]Patent:WO2013/174780,2013,A1.Locationinpatent:Page/Pagecolumn204

[2]JournalofMedicinalChemistry,2015,vol.58,p.401-418

1496582-28-5   
CASUnavailable 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/174780,2013,A1

[2]Patel,Snahel;Cohen,Frederick;Dean,BrianJ.;DeLaTorre,Kelly;Deshmukh,Gauri;Estrada,AnthonyA.;Ghosh,ArundhatiSengupta;Gibbons,Paul;Gustafson,Amy;Huestis,MalcolmP.;LePichon,ClaireE.;Lin,Han;Liu,Wendy;Liu,Xingrong;Liu,Yichin;Ly,CuongQ.;Lyssikatos,JosephP.;Ma,Changyou;Scearce-Levie,Kimberly;Shin,YoungG.;Solanoy,Hilda;Stark,KimberlyL.;Wang,Jian;Wang,Bei;Zhao,Xianrui;Lewcock,JosephW.;Siu,Michael[JournalofMedicinalChemistry,2015,vol.58,#1,p.401-418]

Literature

Title: Scaffold-Hopping and Structure-Based Discovery of Potent, Selective, And Brain Penetrant N-(1H-Pyrazol-3-yl)pyridin-2-amine Inhibitors of Dual Leucine Zipper Kinase (DLK, MAP3K12).

Journal: Journal of medicinal chemistry 20151022

Title: Discovery of dual leucine zipper kinase (DLK, MAP3K12) inhibitors with activity in neurodegeneration models.

Journal: Journal of medicinal chemistry 20150108

Title: Development of dihydropyridone indazole amides as selective Rho-kinase inhibitors.

Journal: Journal of medicinal chemistry 20070111

Title: Patel S et al. Discovery of dual leucine zipper kinase (DLK, MAP3K12) inhibitors with activity in neurodegeneration models. J Med Chem. 2015 Jan 8;58(1):401-18.

Title: Chen Jiang, et al. Neuronal Dual Leucine Zipper Kinase Mediates Inflammatory and Nociceptive Responses in Cyclophosphamide-Induced Cystitis. J Innate Immun

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Tags:1496581-76-0 Molecular Formula|1496581-76-0 MDL|1496581-76-0 SMILES|1496581-76-0 GNE-3511
Catalog No.: AA00ABPE
1496581-76-0,MFCD28502215
1496581-76-0 | GNE-3511
Pack Size： 1mg
Purity： 98+%
in stock
$45.00 $32.00
Pack Size： 5mg
Purity： 98+%
in stock
$112.00 $78.00
Pack Size： 10mg
Purity： 98+%
in stock
$144.00 $101.00
Pack Size： 25mg
Purity： 98+%
in stock
$245.00 $171.00
Pack Size： 500mg
Purity： 98% by HPLC
in stock
$3,958.00 $2,771.00
Pack Size： 1000mg
Purity： 98% by HPLC
in stock
$6,295.00 $4,407.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00ABPE
Chemical Name: GNE-3511
CAS Number: 1496581-76-0
Molecular Formula: C23H26F2N6O
Molecular Weight: 440.4889
MDL Number: MFCD28502215
SMILES: N#Cc1ccnc(c1)Nc1cc(cc(n1)N1CCC(C1)(F)F)C1CCN(CC1)C1COC1
Properties
Complexity: 689  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 32  
Hydrogen Bond Acceptor Count: 9  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 5  
XLogP3: 3.2  
Downstream Synthesis Route
98027-84-0    1496581-76-0 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/174780,2013,A1

[2]Patel,Snahel;Cohen,Frederick;Dean,BrianJ.;DeLaTorre,Kelly;Deshmukh,Gauri;Estrada,AnthonyA.;Ghosh,ArundhatiSengupta;Gibbons,Paul;Gustafson,Amy;Huestis,MalcolmP.;LePichon,ClaireE.;Lin,Han;Liu,Wendy;Liu,Xingrong;Liu,Yichin;Ly,CuongQ.;Lyssikatos,JosephP.;Ma,Changyou;Scearce-Levie,Kimberly;Shin,YoungG.;Solanoy,Hilda;Stark,KimberlyL.;Wang,Jian;Wang,Bei;Zhao,Xianrui;Lewcock,JosephW.;Siu,Michael[JournalofMedicinalChemistry,2015,vol.58,#1,p.401-418]

1496582-75-2    1496581-76-0 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/174780,2013,A1

[2]Patel,Snahel;Cohen,Frederick;Dean,BrianJ.;DeLaTorre,Kelly;Deshmukh,Gauri;Estrada,AnthonyA.;Ghosh,ArundhatiSengupta;Gibbons,Paul;Gustafson,Amy;Huestis,MalcolmP.;LePichon,ClaireE.;Lin,Han;Liu,Wendy;Liu,Xingrong;Liu,Yichin;Ly,CuongQ.;Lyssikatos,JosephP.;Ma,Changyou;Scearce-Levie,Kimberly;Shin,YoungG.;Solanoy,Hilda;Stark,KimberlyL.;Wang,Jian;Wang,Bei;Zhao,Xianrui;Lewcock,JosephW.;Siu,Michael[JournalofMedicinalChemistry,2015,vol.58,#1,p.401-418]

2-chloro-6-(3,3-difluoropyrrolidin-1-yl)-4-(1-(oxetan-3-yl)-piperidin-4-yl)pyridine 
  42182-27-4   
2-((6-(3,3-difluoropyrrolidin-1-yl)-4-(1-(oxetan-3-yl)-piperidin-4-yl)pyridin-2-yl)amino)isonicotinonitrile 

[1]Patent:WO2013/174780,2013,A1.Locationinpatent:Page/Pagecolumn204

[2]JournalofMedicinalChemistry,2015,vol.58,p.401-418

1496582-28-5   
CASUnavailable 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/174780,2013,A1

[2]Patel,Snahel;Cohen,Frederick;Dean,BrianJ.;DeLaTorre,Kelly;Deshmukh,Gauri;Estrada,AnthonyA.;Ghosh,ArundhatiSengupta;Gibbons,Paul;Gustafson,Amy;Huestis,MalcolmP.;LePichon,ClaireE.;Lin,Han;Liu,Wendy;Liu,Xingrong;Liu,Yichin;Ly,CuongQ.;Lyssikatos,JosephP.;Ma,Changyou;Scearce-Levie,Kimberly;Shin,YoungG.;Solanoy,Hilda;Stark,KimberlyL.;Wang,Jian;Wang,Bei;Zhao,Xianrui;Lewcock,JosephW.;Siu,Michael[JournalofMedicinalChemistry,2015,vol.58,#1,p.401-418]

Literature fold

Title: Scaffold-Hopping and Structure-Based Discovery of Potent, Selective, And Brain Penetrant N-(1H-Pyrazol-3-yl)pyridin-2-amine Inhibitors of Dual Leucine Zipper Kinase (DLK, MAP3K12).

Journal: Journal of medicinal chemistry20151022

Title: Discovery of dual leucine zipper kinase (DLK, MAP3K12) inhibitors with activity in neurodegeneration models.

Journal: Journal of medicinal chemistry20150108

Title: Development of dihydropyridone indazole amides as selective Rho-kinase inhibitors.

Journal: Journal of medicinal chemistry20070111

Title: Patel S et al. Discovery of dual leucine zipper kinase (DLK, MAP3K12) inhibitors with activity in neurodegeneration models. J Med Chem. 2015 Jan 8;58(1):401-18.

Title: Chen Jiang, et al. Neuronal Dual Leucine Zipper Kinase Mediates Inflammatory and Nociceptive Responses in Cyclophosphamide-Induced Cystitis. J Innate Immun

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