Home Amines 654-62-6
654-62-6,MFCD00197629
Catalog No.:AA003KNF

654-62-6 | 2-Amino-4-trifluoromethyl-1,5-benzenedisulfonamide

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003KNF
Chemical Name:
2-Amino-4-trifluoromethyl-1,5-benzenedisulfonamide
CAS Number:
654-62-6
Molecular Formula:
C7H8F3N3O4S2
Molecular Weight:
319.2813
MDL Number:
MFCD00197629
SMILES:
Nc1cc(c(cc1S(=O)(=O)N)S(=O)(=O)N)C(F)(F)F
NSC Number:
44625
Properties
Properties
 
BP:
562.8±60.0 °C at 760 mmHg  
Form:
Solid  
MP:
241-246 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
533  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
-0.2  

Downstream Synthesis Route

[1]Holdregeetal.[JournaloftheAmericanChemicalSociety,1959,vol.81,p.4807,4808]

[2]Cragoe,E.J.etal.[Journalofmedicinalandpharmaceuticalchemistry,1962,vol.5,p.896-912]

[1]Holdregeetal.[JournaloftheAmericanChemicalSociety,1959,vol.81,p.4807,4808]

[2]Novello,F.C.etal.[JournalofOrganicChemistry,1960,vol.25,p.970-981]

[3]Close,W.J.etal.[JournaloftheAmericanChemicalSociety,1960,vol.82,p.1132-1135]

[4]Yale,H.L.etal.[JournaloftheAmericanChemicalSociety,1960,vol.82,p.2042-2046]

[5]Klosa,J.;Voigt,H.[JournalfurpraktischeChemie(Leipzig1954),1962,vol.16,p.264-276]

[1]Holdregeetal.[JournaloftheAmericanChemicalSociety,1959,vol.81,p.4807,4808]

[2]CRAVERI;ZONI[BollettinoChimicoFarmaceutico,1961,vol.100,p.956-971]

[3]Klosa,J.;Voigt,H.[JournalfurpraktischeChemie(Leipzig1954),1962,vol.16,p.264-276]

[1]Holdregeetal.[JournaloftheAmericanChemicalSociety,1959,vol.81,p.4807,4808]

[1]Cragoe,E.J.etal.[Journalofmedicinalandpharmaceuticalchemistry,1962,vol.5,p.896-912]

Literature

Title: Molecular cloning, characterization, and inhibition studies of a β-carbonic anhydrase from Malassezia globosa, a potential antidandruff target.

Journal: Journal of medicinal chemistry 20120412

Title: Cloning, characterization and sulfonamide inhibition studies of an α-carbonic anhydrase from the living fossil sponge Astrosclera willeyana.

Journal: Bioorganic & medicinal chemistry 20120215

Title: Inhibition studies of the β-carbonic anhydrases from the bacterial pathogen Salmonella enterica serovar Typhimurium with sulfonamides and sulfamates.

Journal: Bioorganic & medicinal chemistry 20110815

Title: A new β-carbonic anhydrase from Brucella suis, its cloning, characterization, and inhibition with sulfonamides and sulfamates, leading to impaired pathogen growth.

Journal: Bioorganic & medicinal chemistry 20110201

Title: Carbonic anhydrase inhibitors. Inhibition studies with anions and sulfonamides of a new cytosolic enzyme from the scleractinian coral Stylophora pistillata.

Journal: Bioorganic & medicinal chemistry letters 20110115

Title: Coumarinyl-substituted sulfonamides strongly inhibit several human carbonic anhydrase isoforms: solution and crystallographic investigations.

Journal: Bioorganic & medicinal chemistry 20100715

Title: Cloning, characterization, and inhibition studies of a beta-carbonic anhydrase from Brucella suis.

Journal: Journal of medicinal chemistry 20100311

Title: Carbonic anhydrase inhibitors. Characterization and inhibition studies of the most active beta-carbonic anhydrase from Mycobacterium tuberculosis, Rv3588c.

Journal: Bioorganic & medicinal chemistry letters 20091201

Title: Carbonic anhydrase inhibitors. Inhibition studies of a coral secretory isoform by sulfonamides.

Journal: Bioorganic & medicinal chemistry 20090715

Title: Carbonic anhydrase inhibitors. Inhibition and homology modeling studies of the fungal beta-carbonic anhydrase from Candida albicans with sulfonamides.

Journal: Bioorganic & medicinal chemistry 20090701

Title: Carbonic anhydrase inhibitors. Cloning, characterization, and inhibition studies of a new beta-carbonic anhydrase from Mycobacterium tuberculosis.

Journal: Journal of medicinal chemistry 20090514

Title: Molecular cloning, characterization, and inhibition studies of the Rv1284 beta-carbonic anhydrase from Mycobacterium tuberculosis with sulfonamides and a sulfamate.

Journal: Journal of medicinal chemistry 20090423

Title: Carbonic anhydrase inhibitors: inhibition of the beta-class enzyme from the yeast Saccharomyces cerevisiae with sulfonamides and sulfamates.

Journal: Bioorganic & medicinal chemistry 20090201

Title: Carbonic anhydrase inhibitors: cloning, characterization, and inhibition studies of the cytosolic isozyme III with sulfonamides.

Journal: Bioorganic & medicinal chemistry 20071201

Title: Carbonic anhydrase inhibitors: inhibition of human, bacterial, and archaeal isozymes with benzene-1,3-disulfonamides--solution and crystallographic studies.

Journal: Bioorganic & medicinal chemistry letters 20070801

Title: Carbonic anhydrase inhibitors: the beta-carbonic anhydrase from Helicobacter pylori is a new target for sulfonamide and sulfamate inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20070701

Title: Carbonic anhydrase inhibitors. DNA cloning, characterization, and inhibition studies of the human secretory isoform VI, a new target for sulfonamide and sulfamate inhibitors.

Journal: Journal of medicinal chemistry 20070125

Title: Carbonic anhydrase inhibitors: cloning and sulfonamide inhibition studies of a carboxyterminal truncated alpha-carbonic anhydrase from Helicobacter pylori.

Journal: Bioorganic & medicinal chemistry letters 20060415

Title: Antibacterial, antifungal and cytotoxic properties of some sulfonamide-derived chromones.

Journal: Journal of enzyme inhibition and medicinal chemistry 20060401

Title: Carbonic anhydrase inhibitors: DNA cloning and inhibition studies of the alpha-carbonic anhydrase from Helicobacter pylori, a new target for developing sulfonamide and sulfamate gastric drugs.

Journal: Journal of medicinal chemistry 20060323

Title: Carbonic anhydrase inhibitors. The mitochondrial isozyme VB as a new target for sulfonamide and sulfamate inhibitors.

Journal: Journal of medicinal chemistry 20051201

Title: Carbonic anhydrase inhibitors: inhibition of the transmembrane isozyme XIV with sulfonamides.

Journal: Bioorganic & medicinal chemistry letters 20050901

Title: Carbonic anhydrase inhibitors. Inhibition of cytosolic/tumor-associated carbonic anhydrase isozymes I, II, IX, and XII with Schiff's bases incorporating chromone and aromatic sulfonamide moieties, and their zinc complexes.

Journal: Bioorganic & medicinal chemistry letters 20050615

Title: Carbonic anhydrase inhibitors. Inhibition of the transmembrane isozyme XII with sulfonamides-a new target for the design of antitumor and antiglaucoma drugs?

Journal: Bioorganic & medicinal chemistry letters 20050215

Title: Carbonic anhydrase inhibitors. Inhibition of the human cytosolic isozyme VII with aromatic and heterocyclic sulfonamides.

Journal: Bioorganic & medicinal chemistry letters 20050215

Title: Carbonic anhydrase inhibitors. Inhibition of the membrane-bound human and bovine isozymes IV with sulfonamides.

Journal: Bioorganic & medicinal chemistry letters 20050215

Title: Carbonic anhydrase inhibitors. Inhibition of the prokariotic beta and gamma-class enzymes from Archaea with sulfonamides.

Journal: Bioorganic & medicinal chemistry letters 20041220

Title: Carbonic anhydrase inhibitors: inhibition of human cytosolic isozyme II and mitochondrial isozyme V with a series of benzene sulfonamide derivatives.

Journal: Bioorganic & medicinal chemistry letters 20041115

Title: Carbonic anhydrase inhibitors: the first QSAR study on inhibition of tumor-associated isoenzyme IX with aromatic and heterocyclic sulfonamides.

Journal: Bioorganic & medicinal chemistry letters 20040621

Title: Carbonic anhydrase inhibitors: inhibition of the tumor-associated isozyme IX with aromatic and heterocyclic sulfonamides.

Journal: Bioorganic & medicinal chemistry letters 20030324

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Tags:654-62-6 Molecular Formula|654-62-6 MDL|654-62-6 SMILES|654-62-6 2-Amino-4-trifluoromethyl-1,5-benzenedisulfonamide