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342013-63-2,MFCD01788343
Catalog No.:AA00BZX6

342013-63-2 | 3-((1-Methyl-1H-benzo[d]imidazol-2-yl)thio)propanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
1 week  
$384.00   $269.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00BZX6
Chemical Name:
3-((1-Methyl-1H-benzo[d]imidazol-2-yl)thio)propanoic acid
CAS Number:
342013-63-2
Molecular Formula:
C11H12N2O2S
Molecular Weight:
236.2902
MDL Number:
MFCD01788343
SMILES:
CN1C2=CC=CC=C2N=C1SCCC(=O)O
Properties
Computed Properties
 
Complexity:
262  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.6  

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:342013-63-2 Molecular Formula|342013-63-2 MDL|342013-63-2 SMILES|342013-63-2 3-((1-Methyl-1H-benzo[d]imidazol-2-yl)thio)propanoic acid
Catalog No.: AA00BZX6
342013-63-2,MFCD01788343
342013-63-2 | 3-((1-Methyl-1H-benzo[d]imidazol-2-yl)thio)propanoic acid
Pack Size： 1g
Purity：
1 week
$384.00 $269.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00BZX6
Chemical Name: 3-((1-Methyl-1H-benzo[d]imidazol-2-yl)thio)propanoic acid
CAS Number: 342013-63-2
Molecular Formula: C11H12N2O2S
Molecular Weight: 236.2902
MDL Number: MFCD01788343
SMILES: CN1C2=CC=CC=C2N=C1SCCC(=O)O
Properties
Complexity: 262  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.6  
Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

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