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52191-26-1,MFCD00120131
Catalog No.:AA00DDV6

52191-26-1 | 3-(2-(Chloroacetamido)ethyl)indole

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1g
98%
in stock  
$42.00   $30.00
- +
5g
98%
in stock  
$103.00   $73.00
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10g
98%
in stock  
$170.00   $119.00
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25g
98%
in stock  
$336.00   $235.00
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100g
98%
in stock  
$976.00   $683.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DDV6
Chemical Name:
3-(2-(Chloroacetamido)ethyl)indole
CAS Number:
52191-26-1
Molecular Formula:
C12H13ClN2O
Molecular Weight:
236.6974
MDL Number:
MFCD00120131
SMILES:
ClCC(=O)NCCc1c[nH]c2c1cccc2
Properties
Computed Properties
 
Complexity:
247  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
2.4  

Downstream Synthesis Route

[1]Vecchietti;Clarke;Colle;Giardina;Petrone;Sbacchi[JournalofMedicinalChemistry,1991,vol.34,#8,p.2624-2633]

[2]Cho,Su-Dong;Song,Sang-Yong;Park,Yong-Dae;Kim,Jeum-Jong;Joo,Woo-Hong;Shiro,Motoo;Falck;Shin,Dong-Soo;Yoon,Yong-Jin[TetrahedronLetters,2003,vol.44,#50,p.8995-8998]

[3]CurrentPatentAssignee:SUNYAT-SENUNIVERSITY(CHINA)-CN105906608,2016,ALocationinpatent:Paragraph0058;0061

[4]Chang,Meng-Yang;Chen,Shui-Tein;Chang,Nein-Chen[Heterocycles,2003,vol.60,#1,p.99-112]

[5]Oliveira,RafaelR.B.;Brito,ThaysnaraB.;Nepel,Angelita;Costa,EmmanoelV.;Barison,Andersson;Nunes,RogériaS.;Santos,RoseliL.C.;Cavalcanti,SócratesC.H.[MedicinalChemistry,2014,vol.10,#6,p.580-587]

[6]v.Braun;Bahn;Muench[ChemischeBerichte,1929,vol.62,p.2769]

[7]Chang,Meng-Yang;Chen,Shui-Tein;Chang,Nein-Chen[Tetrahedron,2002,vol.58,#25,p.5075-5080]

[8]Chang,Meng-Yang;Chen,Shui-Tein;Chang,Nein-Chen[Heterocycles,2002,vol.57,#12,p.2321-2334]

[9]Chang,Meng-Yang;Chen,Chung-Yi;Chen,Shui-Tein;Chang,Nein-Chen[Tetrahedron,2003,vol.59,#38,p.7547-7553]

[10]Locationinpatent:schemeortableKoelzer,Michael;Weitzel,Kerstin;Goeringer,H.Ulrich;Thines,Eckhard;Opatz,Till[ChemMedChem,2010,vol.5,#9,p.1456-1464]

[11]Costa,ÂngelaC.F.;Cavalcanti,SócratesC.H.;Santana,AlissonS.;Lima,AnaP.S.;Brito,ThaysnaraB.;Oliveira,RafaelR.B.;Macêdo,NatháliaA.;Cristaldo,PauloF.;Araújo,AnaPaulaA.;Bacci,Leandro[Ecotoxicology,2019,vol.28,#8,p.973-982]

[12]Mitkari,SuhasBalasaheb;Medina-Ortíz,Alberto;Olivares-Romero,JoséLuis;Vázquez,MiguelA.;Peña-Cabrera,Eduardo;VillegasGómez,Clarisa;CruzCruz,David[Chemistry-AEuropeanJournal,2021,vol.27,#2,p.618-621]

52191-26-1   
1-chloromethyl-4,9-dihydro-3<i>H</i>-β-carboline 

[1]Swan[JournaloftheChemicalSociety,1950,p.1534,1536]

[2]Locationinpatent:bodytextEspinoza-Moraga,Marlene;Petta,Tania;Vasquez-Vasquez,Marco;Laurie,V.Felipe;Moraes,LuisA.B.;Santos,LeonardoSilva[TetrahedronAsymmetry,2010,vol.21,#16,p.1988-1992]

[1]Naruto;Yonemitsu[ChemicalandPharmaceuticalBulletin,1980,vol.28,#3,p.900-909]

[1]Vecchietti;Clarke;Colle;Giardina;Petrone;Sbacchi[JournalofMedicinalChemistry,1991,vol.34,#8,p.2624-2633]

Literature

Title: Mechanistic studies on the alkyltransferase activity of serotonin N-acetyltransferase.

Journal: Chemistry & biology 20010401

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