Home Amines 20871-07-2
20871-07-2,MFCD00432434
Catalog No.:AA01F4GT

20871-07-2 | 4-Amino-2-(p-tolyl)isoindoline-1,3-dione

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  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA01F4GT
Chemical Name:
4-Amino-2-(p-tolyl)isoindoline-1,3-dione
CAS Number:
20871-07-2
Molecular Formula:
C15H12N2O2
Molecular Weight:
252.2680
MDL Number:
MFCD00432434
SMILES:
Cc1ccc(cc1)N1C(=O)c2c(C1=O)c(N)ccc2
Properties
Computed Properties
 
Complexity:
388  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.7  

Literature

Title: Structure-based discovery of novel chemotypes for adenosine A(2A) receptor antagonists.

Journal: Journal of medicinal chemistry 20100225

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SDS
Tags:20871-07-2 Molecular Formula|20871-07-2 MDL|20871-07-2 SMILES|20871-07-2 4-Amino-2-(p-tolyl)isoindoline-1,3-dione