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Home Sulfos 2-(Phenylsulfonamido)acetic acid

2-(Phenylsulfonamido)acetic acid

CAS No.:
5398-96-9
Catalog Number:
AG00DNL6
Molecular Formula:
C8H9NO4S
Molecular Weight:
215.2264
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$107
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Product Description
Catalog Number:
AG00DNL6
Chemical Name:
2-(Phenylsulfonamido)acetic acid
CAS Number:
5398-96-9
Molecular Formula:
C8H9NO4S
Molecular Weight:
215.2264
MDL Number:
MFCD00233404
IUPAC Name:
2-(benzenesulfonamido)acetic acid
InChI:
InChI=1S/C8H9NO4S/c10-8(11)6-9-14(12,13)7-4-2-1-3-5-7/h1-5,9H,6H2,(H,10,11)
InChI Key:
WTSZSAHZIMPSDM-UHFFFAOYSA-N
SMILES:
OC(=O)CNS(=O)(=O)c1ccccc1
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.025g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.223g/mol
Monoisotopic Mass:
215.025g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
Title Journal
A diverse series of substituted benzenesulfonamides as aldose reductase inhibitors with antioxidant activity: design, synthesis, and in vitro activity. Journal of medicinal chemistry 20101111
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
2-(4-Bromo-benzene-sulfonamido)acetic acid. Acta crystallographica. Section E, Structure reports online 20090801
2-(2-Iodo-benzenesulfonamido)acetic acid. Acta crystallographica. Section E, Structure reports online 20090301
2-(Benzene-sulfonamido)acetic acid. Acta crystallographica. Section E, Structure reports online 20081201
Design and synthesis of N-(3,5-difluoro-4-hydroxyphenyl)benzenesulfonamides as aldose reductase inhibitors. Bioorganic & medicinal chemistry 20080401
Properties