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Home Deuterated Building Blocks 174609-74-6
174609-74-6,MFCD04972582
Catalog No.:AA001ZPP

174609-74-6 | Benzonitrile, 2-(1-piperazinylmethyl)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$86.00   $60.00
- +
1g
98%(HPLC)
in stock  
$156.00   $109.00
- +
5g
98%(HPLC)
in stock  
$474.00   $332.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001ZPP
Chemical Name:
Benzonitrile, 2-(1-piperazinylmethyl)-
CAS Number:
174609-74-6
Molecular Formula:
C12H15N3
Molecular Weight:
201.2676
MDL Number:
MFCD04972582
SMILES:
N#Cc1ccccc1CN1CCNCC1
Properties
Properties
 
BP:
334.23°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
237  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.8  

Downstream Synthesis Route
174609-74-6    1182358-79-7   
2-((4-(3-(5-oxo-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-1-yl)propyl)piperazin-1-yl)methyl)benzonitrile 

[1]Wei,Zhi-Yu;Cui,Bai-Ri;Cui,Xun;Wu,Yan-Ling;Fu,Yang;Liu,Li-Ping;Piao,Hu-Ri[ChemicalBiologyandDrugDesign,2017,vol.89,#1,p.47-60]

174609-74-6   
C11H11BrN4O3 
 
2-((4-(3-(4-(4-nitrophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)propyl)piperazin-1-yl)methyl)benzonitrile 

[1]Wei,Zhi-Yu;Cui,Bai-Ri;Cui,Xun;Wu,Yan-Ling;Fu,Yang;Liu,Li-Ping;Piao,Hu-Ri[ChemicalBiologyandDrugDesign,2017,vol.89,#1,p.47-60]

[1]CurrentPatentAssignee:MERCK&COINC-US5807857,1998,A

686344-50-3    174609-74-6   
2-({4-8-(2-chlorophenyl)-9-(4-chlorophenyl)-9H-purin-6-ylpiperazin-1-yl}methyl)benzonitrile 

[1]Amato,GeorgeS.;Manke,Amruta;Harris,DanniL.;Wiethe,RobertW.;Vasukuttan,Vineetha;Snyder,RodneyW.;Lefever,TimothyW.;Cortes,Ricardo;Zhang,Yanan;Wang,Shaobin;Runyon,ScottP.;Maitra,Rangan[JournalofMedicinalChemistry,2018,vol.61,#10,p.4370-4385]

174609-74-6    1443358-77-7   
4-amino-2-4-(2-cyanobenzyl)piperazin-1-ylmethyl-6,7-dimethoxyquinazoline 

[1]Agrawal,Neetesh;Machhi,Jatin;Rathwa,Virendra;Kanhed,AshishM.;Patel,Sagar;Murumkar,Prashant;Gandhi,Hardik;Yadav,MangeRam[RSCAdvances,2016,vol.6,#36,p.30661-30682]

Literature
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SDS
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Tags:174609-74-6 Molecular Formula|174609-74-6 MDL|174609-74-6 SMILES|174609-74-6 Benzonitrile, 2-(1-piperazinylmethyl)-