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Home Amines 936940-58-8
936940-58-8,MFCD02334722
Catalog No.:AA00GS1L

936940-58-8 | C-(3-Phenyl-1h-pyrazol-4-yl)-methylamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$112.00   $78.00
- +
250mg
95%
in stock  
$145.00   $102.00
- +
1g
95%
in stock  
$319.00   $224.00
- +
5g
95%
in stock  
$1,258.00   $881.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00GS1L
Chemical Name:
C-(3-Phenyl-1h-pyrazol-4-yl)-methylamine
CAS Number:
936940-58-8
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
MDL Number:
MFCD02334722
SMILES:
NCc1c[nH]nc1c1ccccc1
Properties
Computed Properties
 
Complexity:
154  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
0.7  

Downstream Synthesis Route
2-methyl-3-oxo-3,4-dihydro-2H-1,4benzoxazine-8-carboxylicacid 
  936940-58-8    1644599-04-1 

[1]Rooney,TimothyP.C.;Filippakopoulos,Panagis;Fedorov,Oleg;Picaud,Sarah;Cortopassi,WilianA.;Hay,DuncanA.;Martin,Sarah;Tumber,Anthony;Rogers,CatherineM.;Philpott,Martin;Wang,Minghua;Thompson,AmberL.;Heightman,TomD.;Pryde,DavidC.;Cook,Andrew;Paton,RobertS.;Mueller,Susanne;Knapp,Stefan;Brennan,PaulE.;Conway,StuartJ.[AngewandteChemie-InternationalEdition,2014,vol.53,#24,p.6126-6130][Angew.Chem.,2014,vol.53,#24,p.6126-6130,5]

936940-58-8    120-21-8   
N,N-diethyl-4-(3-phenyl-1H-pyrazol-4-yl)methylaminomethylaniline 

[1]Jumppanen,Mikael;Kinnunen,SiniM.;Välimäki,MikaJ.;Talman,Virpi;Auno,Samuli;Bruun,Tanja;BoijeAfGennäs,Gustav;Xhaard,Henri;Aumüller,IngoB.;Ruskoaho,Heikki;Yli-Kauhaluoma,Jari[JournalofMedicinalChemistry,2019,vol.62,#17,p.8284-8310]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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