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1621175-65-2,MFCD30182283
Catalog No.:AA00ASBM

1621175-65-2 | N-(3-Chloro-4-(((2-(methylamino)-6-(pyridin-2-yl)pyrimidin-4-yl)amino)methyl)phenyl)methanesulfonamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98+%
in stock  
$41.00   $29.00
- +
5mg
98+%
in stock  
$102.00   $72.00
- +
10mg
98+%
in stock  
$153.00   $107.00
- +
25mg
98+%
in stock  
$258.00   $181.00
- +
50mg
98+%
in stock  
$437.00   $306.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00ASBM
Chemical Name:
N-(3-Chloro-4-(((2-(methylamino)-6-(pyridin-2-yl)pyrimidin-4-yl)amino)methyl)phenyl)methanesulfonamide
CAS Number:
1621175-65-2
Molecular Formula:
C18H19ClN6O2S
Molecular Weight:
418.9005
MDL Number:
MFCD30182283
SMILES:
CNc1nc(NCc2ccc(cc2Cl)NS(=O)(=O)C)cc(n1)c1ccccn1
Properties
Computed Properties
 
Complexity:
589  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Downstream Synthesis Route

[1]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

[1]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

20925-27-3   
N-3-chloro-4-2-(methylamino)-6-(2-pyridinyl)-4-pyrimidinylaminomethylphenylmethanesulfonamide 

[1]ACSMedicinalChemistryLetters,2014,vol.5,p.1114-1118

[2]ACSMedicinalChemistryLetters,2014,vol.5,p.1114-1118

[1]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

[2]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

CASUnavailable 
 
CASUnavailable 
  1621175-65-2 

[1]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

Literature

Title: Discovery of 2-Pyridylpyrimidines as the First Orally Bioavailable GPR39 Agonists.

Journal: ACS medicinal chemistry letters 20141009

Title: Peukert S, et al. Discovery of 2-Pyridylpyrimidines as the First Orally Bioavailable GPR39 Agonists. ACS Med Chem Lett. 2014 Aug 4;5(10):1114-8.

Title: Shimizu Y, et al. Rho kinase-dependent desensitization of GPR39; a unique mechanism of GPCR downregulation. Biochem Pharmacol. 2017 Sep 15;140:105-114.

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Tags:1621175-65-2 Molecular Formula|1621175-65-2 MDL|1621175-65-2 SMILES|1621175-65-2 N-(3-Chloro-4-(((2-(methylamino)-6-(pyridin-2-yl)pyrimidin-4-yl)amino)methyl)phenyl)methanesulfonamide
Catalog No.: AA00ASBM
1621175-65-2,MFCD30182283
1621175-65-2 | N-(3-Chloro-4-(((2-(methylamino)-6-(pyridin-2-yl)pyrimidin-4-yl)amino)methyl)phenyl)methanesulfonamide
Pack Size： 1mg
Purity： 98+%
in stock
$41.00 $29.00
Pack Size： 5mg
Purity： 98+%
in stock
$102.00 $72.00
Pack Size： 10mg
Purity： 98+%
in stock
$153.00 $107.00
Pack Size： 25mg
Purity： 98+%
in stock
$258.00 $181.00
Pack Size： 50mg
Purity： 98+%
in stock
$437.00 $306.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00ASBM
Chemical Name: N-(3-Chloro-4-(((2-(methylamino)-6-(pyridin-2-yl)pyrimidin-4-yl)amino)methyl)phenyl)methanesulfonamide
CAS Number: 1621175-65-2
Molecular Formula: C18H19ClN6O2S
Molecular Weight: 418.9005
MDL Number: MFCD30182283
SMILES: CNc1nc(NCc2ccc(cc2Cl)NS(=O)(=O)C)cc(n1)c1ccccn1
Properties
Complexity: 589  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 28  
Hydrogen Bond Acceptor Count: 8  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 7  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
Downstream Synthesis Route
1621176-00-8    1621175-65-2 

[1]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

882424-28-4    1582736-39-7    1621175-65-2 

[1]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

20925-27-3   
N-3-chloro-4-2-(methylamino)-6-(2-pyridinyl)-4-pyrimidinylaminomethylphenylmethanesulfonamide 

[1]ACSMedicinalChemistryLetters,2014,vol.5,p.1114-1118

[2]ACSMedicinalChemistryLetters,2014,vol.5,p.1114-1118

53313-04-5    1621175-65-2 

[1]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

[2]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

CASUnavailable 
 
CASUnavailable 
  1621175-65-2 

[1]Peukert,Stefan;Hughes,Richard;Nunez,Jill;He,Guo;Yan,Zhao;Jain,Rishi;Llamas,Luis;Luchansky,Sarah;Carlson,Adam;Liang,Guiqing;Kunjathoor,Vidya;Pietropaolo,Mike;Shapiro,Jeffrey;Castellana,Anja;Wu,Xiaoping;Bose,Avirup[ACSMedicinalChemistryLetters,2014,vol.5,#10,p.1114-1118]

Literature fold

Title: Discovery of 2-Pyridylpyrimidines as the First Orally Bioavailable GPR39 Agonists.

Journal: ACS medicinal chemistry letters20141009

Title: Peukert S, et al. Discovery of 2-Pyridylpyrimidines as the First Orally Bioavailable GPR39 Agonists. ACS Med Chem Lett. 2014 Aug 4;5(10):1114-8.

Title: Shimizu Y, et al. Rho kinase-dependent desensitization of GPR39; a unique mechanism of GPCR downregulation. Biochem Pharmacol. 2017 Sep 15;140:105-114.

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