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Home Amines 95211-68-0
95211-68-0,MFCD00617279
Catalog No.:AA00IIR4

95211-68-0 | 2-Amino-6-methyl-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid amide

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Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$324.00   $227.00
- +
5g
95%
in stock  
$1,293.00   $905.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IIR4
Chemical Name:
2-Amino-6-methyl-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid amide
CAS Number:
95211-68-0
Molecular Formula:
C10H14N2OS
Molecular Weight:
210.2960
MDL Number:
MFCD00617279
SMILES:
CC1CCc2c(C1)sc(c2C(=O)N)N
Properties
Computed Properties
 
Complexity:
246  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.3  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistry,2009,vol.17,#14,p.5336-5341

[2]BioorganicandMedicinalChemistryLetters,2005,vol.15,#21,p.4731-4735

Literature

Title: Novel small molecule inhibitors of MDR Mycobacterium tuberculosis by NMR fragment screening of antigen 85C.

Journal: Journal of medicinal chemistry 20101209

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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Tags:95211-68-0 Molecular Formula|95211-68-0 MDL|95211-68-0 SMILES|95211-68-0 2-Amino-6-methyl-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid amide