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40133-08-2,MFCD01927322
Catalog No.:AA00C8H5

40133-08-2 | 5,6,7,8-Tetrahydro-4h-cyclohepta[b]thiophene-2-carboxylic acid

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100mg
98%
in stock  
$72.00   $50.00
- +
1g
98%
in stock  
$300.00   $210.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00C8H5
Chemical Name:
5,6,7,8-Tetrahydro-4h-cyclohepta[b]thiophene-2-carboxylic acid
CAS Number:
40133-08-2
Molecular Formula:
C10H12O2S
Molecular Weight:
196.2661
MDL Number:
MFCD01927322
SMILES:
OC(=O)c1cc2c(s1)CCCCC2
Properties
Computed Properties
 
Complexity:
205  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3.2  

Downstream Synthesis Route
40133-08-2    20662-53-7   
1-(1-(5,6,7,8-tetrahydro-4H-cycloheptabthiophene-2-carbonyl)piperidin-4-yl)-1,3-dihydro-2H-benzodimidazole-2-one 

[1]GuedesdeLaCruz,Gema;Svobodova,Barbora;Lichtenegger,Michaela;Tiapko,Oleksandra;Groschner,Klaus;Glasnov,Toma[Synlett,2017,vol.28,#6,p.695-700]

40133-08-2    53786-28-0   
5-chloro-1-(1-(5,6,7,8-tetrahydro-4H-cycloheptabthiophene-2-carbonyl)piperidin-4-yl)-1,3-dihydro-2H-benzodimidazole-2-one 

[1]GuedesdeLaCruz,Gema;Svobodova,Barbora;Lichtenegger,Michaela;Tiapko,Oleksandra;Groschner,Klaus;Glasnov,Toma[Synlett,2017,vol.28,#6,p.695-700]

40133-08-2    337912-33-1   
5-nitro-1-(1-(5,6,7,8-tetrahydro-4H-cycloheptabthiophene-2-carbonyl)piperidin-4-yl)-1,3-dihydro-2H-benzodimidazol-2-one 

[1]GuedesdeLaCruz,Gema;Svobodova,Barbora;Lichtenegger,Michaela;Tiapko,Oleksandra;Groschner,Klaus;Glasnov,Toma[Synlett,2017,vol.28,#6,p.695-700]

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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SDS
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Tags:40133-08-2 Molecular Formula|40133-08-2 MDL|40133-08-2 SMILES|40133-08-2 5,6,7,8-Tetrahydro-4h-cyclohepta[b]thiophene-2-carboxylic acid |Heterocyclic_Building_Blocks