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959241-61-3,MFCD09864619
Catalog No.:AA005WE4

959241-61-3 | (7-Methyl-2-oxo-2,3-dihydro-1h-indol-3-yl)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$81.00   $57.00
- +
5g
95%
in stock  
$321.00   $225.00
- +
10g
95%
in stock  
$523.00   $366.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA005WE4
Chemical Name:
(7-Methyl-2-oxo-2,3-dihydro-1h-indol-3-yl)acetic acid
CAS Number:
959241-61-3
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD09864619
SMILES:
Cc1cccc2c1NC(=O)C2CC(=O)O
Properties
Properties
 
Storage:
2-8℃;Keep in dry area;  

Computed Properties
 
Complexity:
290  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.7  

Downstream Synthesis Route

[1]Kathman,StefanG.;Xu,Ziyang;Statsyuk,AlexanderV.[JournalofMedicinalChemistry,2014,vol.57,#11,p.4969-4974]

959241-61-3    139200-39-8   
C16H18N2O4 

[1]Kathman,StefanG.;Xu,Ziyang;Statsyuk,AlexanderV.[JournalofMedicinalChemistry,2014,vol.57,#11,p.4969-4974]

959241-61-3   
C10H17NO4*C2HF3O2 
 
C16H18N2O4 

[1]McShan,Danielle;Kathman,Stefan;Lowe,Brittiney;Xu,Ziyang;Zhan,Jennifer;Statsyuk,Alexander;Ogungbe,IfedayoVictor[BioorganicandMedicinalChemistryLetters,2015,vol.25,#20,p.4509-4512]

959241-61-3   
(S)-2-amino-N-methyl-N,3-diphenylpropanamide2,2,2-trifluoroacetate 
 
(2S)-N-methyl-2-(2-(7-methyl-2-oxoindolin-3-yl)acetamido)-N,3-diphenylpropanamide 

[1]Casey,MaryC.;Du,Haijuan;Hachiya,Atsuko;Kankanala,Jayakanth;Kirby,KarenA.;Sahani,RajkumarLalji;Sarafianos,StefanG.;Tedbury,PhilipR.;Vernekar,SanjeevKumarV.;Wang,Lei;Wang,Zhengqiang;Xie,Jiashu;Zhang,Huanchun[EuropeanJournalofMedicinalChemistry,2020,vol.204]

959241-61-3   
C16H17FN2O*C2HF3O2 
 
(2S)-N-(3-fluorophenyl)-N-methyl-2-(2-(7-methyl-2-oxoindolin-3-yl)acetamido)-3-phenylpropanamide 

[1]Casey,MaryC.;Du,Haijuan;Hachiya,Atsuko;Kankanala,Jayakanth;Kirby,KarenA.;Sahani,RajkumarLalji;Sarafianos,StefanG.;Tedbury,PhilipR.;Vernekar,SanjeevKumarV.;Wang,Lei;Wang,Zhengqiang;Xie,Jiashu;Zhang,Huanchun[EuropeanJournalofMedicinalChemistry,2020,vol.204]

Literature
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SDS
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Tags:959241-61-3 Molecular Formula|959241-61-3 MDL|959241-61-3 SMILES|959241-61-3 (7-Methyl-2-oxo-2,3-dihydro-1h-indol-3-yl)acetic acid |Heterocyclic_Building_Blocks