Home Sulfos Benzene-1,3-disulfonamide

Benzene-1,3-disulfonamide

CAS No.:
3701-01-7
Catalog Number:
AG0034HN
Molecular Formula:
C6H8N2O4S2
Molecular Weight:
236.2687
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
200mg
>98.0%(HPLC)(N)
1 week
United States
$263
- +
Product Description
Catalog Number:
AG0034HN
Chemical Name:
Benzene-1,3-disulfonamide
CAS Number:
3701-01-7
Molecular Formula:
C6H8N2O4S2
Molecular Weight:
236.2687
MDL Number:
MFCD00025383
IUPAC Name:
benzene-1,3-disulfonamide
InChI:
InChI=1S/C6H8N2O4S2/c7-13(9,10)5-2-1-3-6(4-5)14(8,11)12/h1-4H,(H2,7,9,10)(H2,8,11,12)
InChI Key:
HUYYFHGIHVULSU-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1cccc(c1)S(=O)(=O)N
Properties
Complexity:
351  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.993g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.26g/mol
Monoisotopic Mass:
235.993g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Literature
Title Journal
Carbonic anhydrase inhibitors: purification and inhibition studies of pigeon (Columba livia var. domestica) red blood cell carbonic anhydrase with sulfonamides. Journal of enzyme inhibition and medicinal chemistry 20111001
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Coumarinyl-substituted sulfonamides strongly inhibit several human carbonic anhydrase isoforms: solution and crystallographic investigations. Bioorganic & medicinal chemistry 20100715
Carbonic anhydrase inhibitors: inhibition of human, bacterial, and archaeal isozymes with benzene-1,3-disulfonamides--solution and crystallographic studies. Bioorganic & medicinal chemistry letters 20070801
Carbonic anhydrase inhibitors: inhibition of the human transmembrane isozyme XIV with a library of aromatic/heterocyclic sulfonamides. Bioorganic & medicinal chemistry 20051115
Carbonic anhydrase inhibitors: inhibition of the tumor-associated isozymes IX and XII with a library of aromatic and heteroaromatic sulfonamides. Bioorganic & medicinal chemistry letters 20051101
Carbonic anhydrase inhibitors: inhibition of the transmembrane isozyme XIV with sulfonamides. Bioorganic & medicinal chemistry letters 20050901
Carbonic anhydrase inhibitors. Inhibition of the prokariotic beta and gamma-class enzymes from Archaea with sulfonamides. Bioorganic & medicinal chemistry letters 20041220
Carbonic anhydrase inhibitors: inhibition of the tumor-associated isozyme IX with aromatic and heterocyclic sulfonamides. Bioorganic & medicinal chemistry letters 20030324
Properties