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Benzothiazole sulfonamide

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Identification
Molecular formula
C21H15N4O3S2
CAS number
123456-78-9
IUPAC name
4-[(7-hydroxy-6H-pyrrolo[2,3-g][1,3]benzothiazol-8-yl)methyleneamino]-N-(2-pyridyl)benzenesulfonamide
State
State

At room temperature, this compound is typically found as a solid. Due to its complex molecular structure, it is not volatile and remains in a stable solid form under standard conditions.

Melting point (Celsius)
310.00
Melting point (Kelvin)
583.15
Boiling point (Celsius)
746.60
Boiling point (Kelvin)
1 019.75
General information
Molecular weight
421.48g/mol
Molar mass
421.4750g/mol
Density
1.5400g/cm3
Appearence

The compound is typically observed as a crystalline solid. It may appear as a yellow or pale yellow powder, depending on its purity and conditions of synthesis.

Comment on solubility

Solubility of 4-[(7-hydroxy-6H-pyrrolo[2,3-g][1,3]benzothiazol-8-yl)methyleneamino]-N-(2-pyridyl)benzenesulfonamide

The compound 4-[(7-hydroxy-6H-pyrrolo[2,3-g][1,3]benzothiazol-8-yl)methyleneamino]-N-(2-pyridyl)benzenesulfonamide, denoted by the formula C21H15N4O3S2, exhibits distinct solubility characteristics. Understanding these properties can provide valuable insights into its applications and behavior in various environments.

Key Points on Solubility:

  • Polar vs. Nonpolar: The presence of sulfonamide and multiple nitrogen functional groups suggests a degree of polarity, which can enhance solubility in polar solvents such as water.
  • Hydrogen Bonding: The compound's structure allows for potential hydrogen bonding, improving interactions with aqueous environments.
  • Solvent Compatibility: It is likely more soluble in organic solvents like dichloromethane and dimethyl sulfoxide (DMSO), dependent on its chemical interactions.
  • pH Dependence: Its solubility may vary at different pH levels due to ionization possibilities, particularly from the sulfonamide functional group.

In summary, the solubility characteristics of this compound are influenced by its polar and hydrogen-bonding capabilities, making it versatile across different solvent systems. As with many complex organic molecules, understanding these attributes is crucial for predicting its behavior in biological and chemical applications.

Interesting facts

Interesting Facts about 4-[(7-hydroxy-6H-pyrrolo[2,3-g][1,3]benzothiazol-8-yl)methyleneamino]-N-(2-pyridyl)benzenesulfonamide

This chemical compound, with a complex structure, plays a significant role in the field of medicinal chemistry, particularly in the development of novel therapeutics. Here are some intriguing points:

  • Multi-functional: Its diverse functional groups suggest potential for a variety of biological activities, which can be explored in different therapeutic contexts.
  • Targeted Research: Compounds like this one are often synthesized in research labs focusing on drug discovery, especially against cancer and infectious diseases.
  • Structural Complexity: The presence of a pyrrolo[2,3-g][1,3]benzothiazole moiety indicates it may interact with various molecular targets, making it a subject of interest for pharmacological studies.
  • Potential Inhibitor: Its sulfonamide group is well-known in pharmaceuticals, particularly for its role in inhibiting certain enzymes and pathways, thus contributing to its importance in drug design.
  • Collaborative Efforts: Research involving this compound often leads to multidisciplinary collaborations among chemists, biologists, and pharmacologists to study its efficacy and safety.

As scientists continue to explore novel compounds like this one, their potential applications in treating challenging diseases remain a beacon of hope in modern medicine. Each connection, interaction, and modification to its structure can reveal new therapeutic possibilities, underlining the importance of such intricate compounds in advancing healthcare.

Synonyms
gw8510
222036-17-1
GW-8510
GW 8510
4-{[(7-Oxo-6,7-dihydro-8H-[1,3]thiazolo[5,4-e]indol-8-ylidene)methyl]amino}-N-(2-pyridyl)benzenesulfonamide
CID 6539118
4-[(7-oxo-6H-pyrrolo[2,3-g][1,3]benzothiazol-8-ylidene)methylamino]-N-(2-pyridinyl)benzenesulfonamide
4-[[(Z)-(7-oxo-6H-pyrrolo[2,3-g][1,3]benzothiazol-8-ylidene)methyl]amino]-N-pyridin-2-ylbenzenesulfonamide
4-[(7-Hydroxy-6H-pyrrolo[2,3-g][1,3]benzothiazol-8-yl)methylideneamino]-N-pyridin-2-ylbenzenesulfonamide
cmpd 4
Kinome_2472
Oxindole (Scaffold V)
GW8510, solid
pyridyl)benzenesulfonamide
4-[(~{E})-(7-oxidanyl-6~{H}-pyrrolo[2,3-g][1,3]benzothiazol-8-yl)methylideneamino]-~{N}-pyridin-2-yl-benzenesulfonamide
ylidene)methyl]amino}-N-(2-
SCHEMBL5576907
CHEMBL1276446
CHEMBL1973540
CHEBI:95283
CDNIYBIKHDLGMT-UHFFFAOYSA-N
GCYXEGSPUDSZJY-UHFFFAOYSA-N
BDBM153742
GLXC-04795
EX-A8123
MFCD03452930
AKOS040745839
NCGC00485610-01
DA-73964
PD121563
HY-112358
CS-0045286
G83750
BRD-K55000304-001-04-4
BRD-K55000304-001-07-7
BRD-K55000304-001-09-3
Q27167138
4-{[(7-Oxo-6,7-dihydro-8H-[1,3]thiazolo[5,4-e]indol-8-
4-[(7-Oxo-6,7-dihydro-1-thia-3,6-diaza-as-indacen-8 ylidenemethyl)-amino]-N-pyridin-2-yl-benzenesulfonamide
4-[(7-Oxo-6,7-dihydro-1-thia-3,6-diaza-as-indacen-8-ylidenemethyl)-amino]-N-pyridin-2-yl-benzenesulfonamide
4-[[(Z)-(7-oxo-6H-pyrrolo[2,3-g][1,3]benzothiazol-8-ylidene)methyl]amino]-N-(2-pyridyl)benzenesulfonamide