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10252-63-8,MFCD05804382
Catalog No.:AA0007KY

10252-63-8 | 4-[(Methylamino)sulfonyl]benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$162.00   $113.00
- +
2.5g
95%
in stock  
$368.00   $258.00
- +
5g
95%
in stock  
$544.00   $381.00
- +
10g
95%
in stock  
$884.00 $619.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0007KY
Chemical Name:
4-[(Methylamino)sulfonyl]benzoic acid
CAS Number:
10252-63-8
Molecular Formula:
C8H9NO4S
Molecular Weight:
215.2264
MDL Number:
MFCD05804382
SMILES:
CNS(=O)(=O)c1ccc(cc1)C(=O)O
Properties
Computed Properties
 
Complexity:
298  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.8  

Downstream Synthesis Route

[1]Patent:WO2004/14900,2004,A1.Locationinpatent:Page51-52

[2]ChemMedChem,2015,vol.10,p.1548-1558

[3]VerslagvandeGewoneVergaderingvandeAfdelingNatuurkunde,KoninklijkeNederlandseAkademievanWetenschappen,vol.32,p.15    ChemischesZentralblatt,1923,vol.94,p.302

[4]Patent:US2008/176926,2008,A1.Locationinpatent:Page/Pagecolumn18

[5]Patent:WO2006/100631,2006,A1.Locationinpatent:Page/Pagecolumn49

[1]Patent:US2016/185785,2016,A1.Locationinpatent:Paragraph2185;2186

Literature

Title: Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design.

Journal: Journal of medicinal chemistry 19971205

Quotation Request
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SDS
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Tags:10252-63-8 Molecular Formula|10252-63-8 MDL|10252-63-8 SMILES|10252-63-8 4-[(Methylamino)sulfonyl]benzoic acid
Catalog No.: AA0007KY
10252-63-8,MFCD05804382
10252-63-8 | 4-[(Methylamino)sulfonyl]benzoic acid
Pack Size： 1g
Purity： 95%
in stock
$162.00 $113.00
Pack Size： 2.5g
Purity： 95%
in stock
$368.00 $258.00
Pack Size： 5g
Purity： 95%
in stock
$544.00 $381.00
Pack Size： 10g
Purity： 95%
in stock
$884.00 $619.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA0007KY
Chemical Name: 4-[(Methylamino)sulfonyl]benzoic acid
CAS Number: 10252-63-8
Molecular Formula: C8H9NO4S
Molecular Weight: 215.2264
MDL Number: MFCD05804382
SMILES: CNS(=O)(=O)c1ccc(cc1)C(=O)O
Properties
Complexity: 298  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.8  
Downstream Synthesis Route
10130-89-9    74-89-5    10252-63-8 

[1]Patent:WO2004/14900,2004,A1.Locationinpatent:Page51-52

[2]ChemMedChem,2015,vol.10,p.1548-1558

[3]VerslagvandeGewoneVergaderingvandeAfdelingNatuurkunde,KoninklijkeNederlandseAkademievanWetenschappen,vol.32,p.15    ChemischesZentralblatt,1923,vol.94,p.302

[4]Patent:US2008/176926,2008,A1.Locationinpatent:Page/Pagecolumn18

[5]Patent:WO2006/100631,2006,A1.Locationinpatent:Page/Pagecolumn49

10130-89-9    593-51-1    10252-63-8 

[1]Patent:US2016/185785,2016,A1.Locationinpatent:Paragraph2185;2186

Literature fold

Title: Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design.

Journal: Journal of medicinal chemistry19971205

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