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438021-60-4,MFCD02712873
Catalog No.:AA00DB9C

438021-60-4 | N,N-Diethyl-3-(5-mercapto-4-phenyl-4H-1,2,4-triazol-3-yl)benzenesulfonamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$133.00   $93.00
- +
100mg
95%
3 weeks  
$175.00   $123.00
- +
250mg
95%
3 weeks  
$222.00   $155.00
- +
500mg
95%
3 weeks  
$370.00   $259.00
- +
1g
95%
3 weeks  
$515.00   $360.00
- +
2.5g
95%
3 weeks  
$956.00   $669.00
- +
5g
95%
3 weeks  
$1,384.00   $969.00
- +
10g
95%
3 weeks  
$2,024.00   $1,417.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DB9C
Chemical Name:
N,N-Diethyl-3-(5-mercapto-4-phenyl-4H-1,2,4-triazol-3-yl)benzenesulfonamide
CAS Number:
438021-60-4
Molecular Formula:
C18H20N4O2S2
Molecular Weight:
388.5070
MDL Number:
MFCD02712873
SMILES:
CCN(S(=O)(=O)c1cccc(c1)c1nnc(n1c1ccccc1)S)CC
Properties
Computed Properties
 
Complexity:
634  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

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:438021-60-4 Molecular Formula|438021-60-4 MDL|438021-60-4 SMILES|438021-60-4 N,N-Diethyl-3-(5-mercapto-4-phenyl-4H-1,2,4-triazol-3-yl)benzenesulfonamide
Catalog No.: AA00DB9C
438021-60-4,MFCD02712873
438021-60-4 | N,N-Diethyl-3-(5-mercapto-4-phenyl-4H-1,2,4-triazol-3-yl)benzenesulfonamide
Pack Size： 50mg
Purity： 95%
3 weeks
$133.00 $93.00
Pack Size： 100mg
Purity： 95%
3 weeks
$175.00 $123.00
Pack Size： 250mg
Purity： 95%
3 weeks
$222.00 $155.00
Pack Size： 500mg
Purity： 95%
3 weeks
$370.00 $259.00
Pack Size： 1g
Purity： 95%
3 weeks
$515.00 $360.00
Pack Size： 2.5g
Purity： 95%
3 weeks
$956.00 $669.00
Pack Size： 5g
Purity： 95%
3 weeks
$1,384.00 $969.00
Pack Size： 10g
Purity： 95%
3 weeks
$2,024.00 $1,417.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DB9C
Chemical Name: N,N-Diethyl-3-(5-mercapto-4-phenyl-4H-1,2,4-triazol-3-yl)benzenesulfonamide
CAS Number: 438021-60-4
Molecular Formula: C18H20N4O2S2
Molecular Weight: 388.5070
MDL Number: MFCD02712873
SMILES: CCN(S(=O)(=O)c1cccc(c1)c1nnc(n1c1ccccc1)S)CC
Properties
Complexity: 634  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 26  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
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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