1431985-92-0,MFCD26936347
Catalog No.:AA009C9Q

1431985-92-0 | 3-[6-Amino-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$7.00   $5.00
- +
10mg
98%
in stock  
$14.00   $10.00
- +
50mg
98%
in stock  
$54.00   $38.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA009C9Q
Chemical Name:
3-[6-Amino-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenol
CAS Number:
1431985-92-0
Molecular Formula:
C20H20N2O4
Molecular Weight:
352.3838
MDL Number:
MFCD26936347
SMILES:
COc1cc(cc(c1OC)OC)c1cc(cnc1N)c1cccc(c1)O
Properties
Computed Properties
 
Complexity:
424  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.3  

Downstream Synthesis Route

[1]Mohedas,AgustinH.;Wang,You;Sanvitale,CarolineE.;Canning,Peter;Choi,Sungwoon;Xing,Xuechao;Bullock,AlexN.;Cuny,GregoryD.;Yu,PaulB.[JournalofMedicinalChemistry,2014,vol.57,#19,p.7900-7915]

[2]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2015/148654,2015,A1

[3]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2016/54406,2016,A1

[1]Mohedas,AgustinH.;Wang,You;Sanvitale,CarolineE.;Canning,Peter;Choi,Sungwoon;Xing,Xuechao;Bullock,AlexN.;Cuny,GregoryD.;Yu,PaulB.[JournalofMedicinalChemistry,2014,vol.57,#19,p.7900-7915]

[2]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2015/148654,2015,A1Locationinpatent:Page/Pagecolumn45

[3]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2016/54406,2016,A1Locationinpatent:Page/Pagecolumn52

[1]Mohedas,AgustinH.;Wang,You;Sanvitale,CarolineE.;Canning,Peter;Choi,Sungwoon;Xing,Xuechao;Bullock,AlexN.;Cuny,GregoryD.;Yu,PaulB.[JournalofMedicinalChemistry,2014,vol.57,#19,p.7900-7915]

[2]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2015/148654,2015,A1

[3]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2016/54406,2016,A1

1450754-37-6    1431985-92-0   
CASUnavailable 

[1]Tong,Yuquan;Gibaut,QuentinM.R.;Rouse,Warren;Childs-Disney,JessicaL.;Suresh,BlessyM.;Abegg,Daniel;Choudhary,Shruti;Akahori,Yoshihiro;Adibekian,Alexander;Moss,WalterN.;Disney,MatthewD.[JournaloftheAmericanChemicalSociety,2022,vol.144,#26,p.11620-11625]

Literature

Title: Structure-activity relationship of 3,5-diaryl-2-aminopyridine ALK2 inhibitors reveals unaltered binding affinity for fibrodysplasia ossificans progressiva causing mutants.

Journal: Journal of medicinal chemistry 20141009

Title: Sanvitale CE, et al. A new class of small molecule inhibitor of BMP signaling. PLoS One. 2013 Apr 30;8(4):e62721.

Title: Kerr G, et al. A small molecule targeting ALK1 prevents Notch cooperativity and inhibits functional angiogenesis. Angiogenesis. 2015 Apr;18(2):209-17.

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SDS
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Tags:1431985-92-0 Molecular Formula|1431985-92-0 MDL|1431985-92-0 SMILES|1431985-92-0 3-[6-Amino-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenol
Catalog No.: AA009C9Q
1431985-92-0,MFCD26936347
1431985-92-0 | 3-[6-Amino-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenol
Pack Size: 1mg
Purity: 98%
in stock
$7.00 $5.00
Pack Size: 10mg
Purity: 98%
in stock
$14.00 $10.00
Pack Size: 50mg
Purity: 98%
in stock
$54.00 $38.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA009C9Q
Chemical Name: 3-[6-Amino-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenol
CAS Number: 1431985-92-0
Molecular Formula: C20H20N2O4
Molecular Weight: 352.3838
MDL Number: MFCD26936347
SMILES: COc1cc(cc(c1OC)OC)c1cc(cnc1N)c1cccc(c1)O
Properties
Complexity: 424  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 26  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 5  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.3  
Downstream Synthesis Route
381233-96-1    1431985-92-0 

[1]Mohedas,AgustinH.;Wang,You;Sanvitale,CarolineE.;Canning,Peter;Choi,Sungwoon;Xing,Xuechao;Bullock,AlexN.;Cuny,GregoryD.;Yu,PaulB.[JournalofMedicinalChemistry,2014,vol.57,#19,p.7900-7915]

[2]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2015/148654,2015,A1

[3]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2016/54406,2016,A1

1627503-64-3    87199-18-6    1431985-92-0 

[1]Mohedas,AgustinH.;Wang,You;Sanvitale,CarolineE.;Canning,Peter;Choi,Sungwoon;Xing,Xuechao;Bullock,AlexN.;Cuny,GregoryD.;Yu,PaulB.[JournalofMedicinalChemistry,2014,vol.57,#19,p.7900-7915]

[2]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2015/148654,2015,A1Locationinpatent:Page/Pagecolumn45

[3]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2016/54406,2016,A1Locationinpatent:Page/Pagecolumn52

182163-96-8    1431985-92-0 

[1]Mohedas,AgustinH.;Wang,You;Sanvitale,CarolineE.;Canning,Peter;Choi,Sungwoon;Xing,Xuechao;Bullock,AlexN.;Cuny,GregoryD.;Yu,PaulB.[JournalofMedicinalChemistry,2014,vol.57,#19,p.7900-7915]

[2]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2015/148654,2015,A1

[3]CurrentPatentAssignee:MASSGENERALBRIGHAMINC-WO2016/54406,2016,A1

1450754-37-6    1431985-92-0   
CASUnavailable 

[1]Tong,Yuquan;Gibaut,QuentinM.R.;Rouse,Warren;Childs-Disney,JessicaL.;Suresh,BlessyM.;Abegg,Daniel;Choudhary,Shruti;Akahori,Yoshihiro;Adibekian,Alexander;Moss,WalterN.;Disney,MatthewD.[JournaloftheAmericanChemicalSociety,2022,vol.144,#26,p.11620-11625]

Literature fold

Title: Structure-activity relationship of 3,5-diaryl-2-aminopyridine ALK2 inhibitors reveals unaltered binding affinity for fibrodysplasia ossificans progressiva causing mutants.

Journal: Journal of medicinal chemistry20141009

Title: Sanvitale CE, et al. A new class of small molecule inhibitor of BMP signaling. PLoS One. 2013 Apr 30;8(4):e62721.

Title: Kerr G, et al. A small molecule targeting ALK1 prevents Notch cooperativity and inhibits functional angiogenesis. Angiogenesis. 2015 Apr;18(2):209-17.

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