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Home Indole and Oxindoles 864445-39-6
864445-39-6,MFCD18382089
Catalog No.:AA00GT8G

864445-39-6 | 1-pentyl-3-(2-methylphenylacetyl)indole

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  • Technical Information
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Technical Information
Catalog Number:
AA00GT8G
Chemical Name:
1-pentyl-3-(2-methylphenylacetyl)indole
CAS Number:
864445-39-6
Molecular Formula:
C22H25NO
Molecular Weight:
319.4400
MDL Number:
MFCD18382089
SMILES:
CCCCCn1cc(c2c1cccc2)C(=O)Cc1ccccc1C
Properties
Computed Properties
 
Complexity:
407  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
7  
XLogP3:
5.4  

Literature

Title: Development of CoMFA and CoMSIA models of affinity and selectivity for indole ligands of cannabinoid CB1 and CB2 receptors.

Journal: European journal of medicinal chemistry 20090601

Title: 1-Pentyl-3-phenylacetylindoles, a new class of cannabimimetic indoles.

Journal: Bioorganic & medicinal chemistry letters 20050915

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SDS
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