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301193-76-0,MFCD00954918
Catalog No.:AA00IWR6

301193-76-0 | 4-(4-tert-butylphenyl)-2-[(4-methylphenyl)sulfanyl]-4-oxobutanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
500mg
>90%
1 week  
$1,087.00   $761.00
- +
1g
>90%
1 week  
$1,960.00   $1,372.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00IWR6
Chemical Name:
4-(4-tert-butylphenyl)-2-[(4-methylphenyl)sulfanyl]-4-oxobutanoic acid
CAS Number:
301193-76-0
Molecular Formula:
C21H24O3S
Molecular Weight:
356.4785
MDL Number:
MFCD00954918
SMILES:
OC(=O)C(CC(=O)c1ccc(cc1)C(C)(C)C)Sc1ccc(cc1)C
Properties
Computed Properties
 
Complexity:
452  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
5.4  

Literature

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

Quotation Request
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SDS
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Tags:301193-76-0 Molecular Formula|301193-76-0 MDL|301193-76-0 SMILES|301193-76-0 4-(4-tert-butylphenyl)-2-[(4-methylphenyl)sulfanyl]-4-oxobutanoic acid
Catalog No.: AA00IWR6
301193-76-0,MFCD00954918
301193-76-0 | 4-(4-tert-butylphenyl)-2-[(4-methylphenyl)sulfanyl]-4-oxobutanoic acid
Pack Size： 1mg
Purity： >90%
1 week
$299.00 $209.00
Pack Size： 5mg
Purity： >90%
1 week
$319.00 $223.00
Pack Size： 10mg
Purity： >90%
1 week
$358.00 $250.00
Pack Size： 500mg
Purity： >90%
1 week
$1,087.00 $761.00
Pack Size： 1g
Purity： >90%
1 week
$1,960.00 $1,372.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00IWR6
Chemical Name: 4-(4-tert-butylphenyl)-2-[(4-methylphenyl)sulfanyl]-4-oxobutanoic acid
CAS Number: 301193-76-0
Molecular Formula: C21H24O3S
Molecular Weight: 356.4785
MDL Number: MFCD00954918
SMILES: OC(=O)C(CC(=O)c1ccc(cc1)C(C)(C)C)Sc1ccc(cc1)C
Properties
Complexity: 452  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 25  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 7  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 5.4  
Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

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 Cytology20060501

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