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159180-54-8,MFCD01238548
Catalog No.:AA001QG9

159180-54-8 | 2-(1-Azepanylcarbonyl)aniline

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1g
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  • Technical Information
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Technical Information
Catalog Number:
AA001QG9
Chemical Name:
2-(1-Azepanylcarbonyl)aniline
CAS Number:
159180-54-8
Molecular Formula:
C13H18N2O
Molecular Weight:
218.2948
MDL Number:
MFCD01238548
SMILES:
Nc1ccccc1C(=O)N1CCCCCC1
Properties
Computed Properties
 
Complexity:
234  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.5  

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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Tags:159180-54-8 Molecular Formula|159180-54-8 MDL|159180-54-8 SMILES|159180-54-8 2-(1-Azepanylcarbonyl)aniline