Home Quinolines 157809-85-3
157809-85-3,MFCD01317860
Catalog No.:AA00AOYS

157809-85-3 | 1-(2-CHLOROPHENYL)-N-(1-METHYLPROPYL)-ISOQUINOLINE-3-CARBOXAMIDE

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  • Properties
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00AOYS
Chemical Name:
1-(2-CHLOROPHENYL)-N-(1-METHYLPROPYL)-ISOQUINOLINE-3-CARBOXAMIDE
CAS Number:
157809-85-3
Molecular Formula:
C20H19ClN2O
Molecular Weight:
338.8307
MDL Number:
MFCD01317860
SMILES:
CCC(C)NC(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=CC=C3Cl
Properties
Computed Properties
 
Complexity:
430  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
5.3  

Literature

Title: [Radiosynthesis of peripheral benzodiazepine receptor radioligand [N-methyl-(11)C]PK 11195 as an imaging agent for positron emission tomography].

Journal: Nan fang yi ke da xue xue bao = Journal of Southern Medical University 20091201

Title: 1-(Phenyl)isoquinoline carboxamides: a novel class of subtype selective inhibitors of thyrotropin-releasing hormone (TRH) receptors.

Journal: Bioorganic & medicinal chemistry letters 20050201

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