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52943-20-1,MFCD08691934
Catalog No.:AA00DIQG

52943-20-1 | 2-Chloro-N-methylnicotinamide

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1g
95%
in stock  
$40.00   $28.00
- +
5g
97%
in stock  
$112.00   $78.00
- +
10g
97%
in stock  
$162.00   $113.00
- +
25g
97%
in stock  
$311.00   $218.00
- +
100g
97%
in stock  
$809.00   $567.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DIQG
Chemical Name:
2-Chloro-N-methylnicotinamide
CAS Number:
52943-20-1
Molecular Formula:
C7H7ClN2O
Molecular Weight:
170.5963
MDL Number:
MFCD08691934
SMILES:
CNC(=O)c1cccnc1Cl
Properties
Computed Properties
 
Complexity:
151  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.1  

Downstream Synthesis Route

[1]Romero;Morge;Biles;Berrios-Pena;May;Palmer;Johnson;Smith;Busso;Tan;Voorman;Reusser;Althaus;Downey;So;Resnick;Tarpley;Aristoff[JournalofMedicinalChemistry,1994,vol.37,#7,p.999-1014]

[1]Dunn,AllanD.;Norrie,Robert[ZeitschriftfurChemie,1988,vol.28,#7,p.248-249]

[2]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2007/78140,2007,A1Locationinpatent:Page/Pagecolumn39

[3]Elworthy,ToddR.;Ford,AnthonyP.D.W.;Bantle,GaryW.;MorgansJr.,DavidJ.;Ozer,RachelS.;Palmer,WylieS.;Repke,DavidB.;Romero,Magarita;Sandoval,Leticia;Sjogren,EricB.;Talamás,FranciscoX.;Vazquez,Alfredo;Wu,Helen;Arredondo,NicolasF.;BlueJr.,DavidR.;DeSousa,Andrea;Gross,LisaM.;Kava,M.Shannon;Lesnick,JohnD.;Vimont,RachelL.;Williams,TimothyJ.;Zhu,Quan-Ming;Pfister,JürgR.;Clarke,DavidE.[JournalofMedicinalChemistry,1997,vol.40,#17,p.2674-2687]

[1]Cook,XinlanA.F.;Pantaine,LoïcR.E.;Blakemore,DavidC.;Moses,IanB.;Sach,NealW.;Shavnya,Andre;Willis,MichaelC.[AngewandteChemie-InternationalEdition,2021,vol.60,#41,p.22461-22468][Angew.Chem.,2021,vol.133,#41,p.22635-22642]

[2]Dunn,AllanD.;Norrie,Robert[ZeitschriftfurChemie,1988,vol.28,#7,p.248-249]

52943-20-1   
(1H-indol-2-yl)(piperazin-1-yl)methanone 
 
1-(indolyl-2-carbamoyl)-4-<3-(N-methylcarbamoyl)-2-pyridyl>piperazine 

[1]Romero;Morge;Biles;Berrios-Pena;May;Palmer;Johnson;Smith;Busso;Tan;Voorman;Reusser;Althaus;Downey;So;Resnick;Tarpley;Aristoff[JournalofMedicinalChemistry,1994,vol.37,#7,p.999-1014]

52943-20-1    20529-23-1   
2-{3-4-(2-Methoxy-phenyl)-piperazin-1-yl-propylamino}-N-methyl-nicotinamide 

[1]Elworthy,ToddR.;Ford,AnthonyP.D.W.;Bantle,GaryW.;MorgansJr.,DavidJ.;Ozer,RachelS.;Palmer,WylieS.;Repke,DavidB.;Romero,Magarita;Sandoval,Leticia;Sjogren,EricB.;Talamás,FranciscoX.;Vazquez,Alfredo;Wu,Helen;Arredondo,NicolasF.;BlueJr.,DavidR.;DeSousa,Andrea;Gross,LisaM.;Kava,M.Shannon;Lesnick,JohnD.;Vimont,RachelL.;Williams,TimothyJ.;Zhu,Quan-Ming;Pfister,JürgR.;Clarke,DavidE.[JournalofMedicinalChemistry,1997,vol.40,#17,p.2674-2687]

Literature
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Tags:52943-20-1 Molecular Formula|52943-20-1 MDL|52943-20-1 SMILES|52943-20-1 2-Chloro-N-methylnicotinamide