2-chloro-4-sulfamoylaniline - CAS 53297-68-0
Catalog: |
BB028124 |
Product Name: |
2-chloro-4-sulfamoylaniline |
CAS: |
53297-68-0 |
Synonyms: |
4-amino-3-chlorobenzenesulfonamide; 4-amino-3-chlorobenzenesulfonamide |
IUPAC Name: | 4-amino-3-chlorobenzenesulfonamide |
Description: | 2-chloro-4-sulfamoylaniline (CAS# 53297-68-0) is a useful research chemical. |
Molecular Weight: | 206.65 |
Molecular Formula: | C6H7ClN2O2S |
Canonical SMILES: | C1=CC(=C(C=C1S(=O)(=O)N)Cl)N |
InChI: | InChI=1S/C6H7ClN2O2S/c7-5-3-4(12(9,10)11)1-2-6(5)8/h1-3H,8H2,(H2,9,10,11) |
InChI Key: | LFIOFZKZCDMGFG-UHFFFAOYSA-N |
Boiling Point: | 414.4 °C at 760 mmHg |
Density: | 1.558 g/cm3 |
LogP: | 2.93190 |
Publication Number | Title | Priority Date |
AU-2010354083-A1 | Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases | 20100526 |
AU-2010354083-B2 | Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases | 20100526 |
CN-103153993-A | Apoptosis inducing agents for the treatment of cancer and immune and autoimmune diseases | 20100526 |
CN-103153993-B | The apoptosis induction medicament for the treatment of cancer and immunity and autoimmune disease | 20100526 |
DK-2576546-T3 | Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases | 20100526 |
PMID | Publication Date | Title | Journal |
28665493 | 20171001 | Assessment of the inhibitory effects and molecular docking of some sulfonamides on human serum paraoxonase 1 | Journal of biochemical and molecular toxicology |
22424239 | 20120412 | Molecular cloning, characterization, and inhibition studies of a β-carbonic anhydrase from Malassezia globosa, a potential antidandruff target | Journal of medicinal chemistry |
22285172 | 20120215 | Cloning, characterization and sulfonamide inhibition studies of an α-carbonic anhydrase from the living fossil sponge Astrosclera willeyana | Bioorganic & medicinal chemistry |
21757360 | 20110815 | Inhibition studies of the β-carbonic anhydrases from the bacterial pathogen Salmonella enterica serovar Typhimurium with sulfonamides and sulfamates | Bioorganic & medicinal chemistry |
21251841 | 20110201 | A new β-carbonic anhydrase from Brucella suis, its cloning, characterization, and inhibition with sulfonamides and sulfamates, leading to impaired pathogen growth | Bioorganic & medicinal chemistry |
Complexity: | 249 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.9916763 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.9916763 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 94.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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