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(4-methyl-1,4-diazepane-1-carbothioyl)sulfanyl 4-methyl-1,4-diazepane-1-carbodithioate

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Identification
Molecular formula
C14H28N4S4
CAS number
5025-67-6
IUPAC name
(4-methyl-1,4-diazepane-1-carbothioyl)sulfanyl 4-methyl-1,4-diazepane-1-carbodithioate
State
State

At room temperature, this compound exists in a solid state, which is typical for many organic compounds of similar structure and molecular weight.

Melting point (Celsius)
145.60
Melting point (Kelvin)
418.75
Boiling point (Celsius)
395.15
Boiling point (Kelvin)
668.30
General information
Molecular weight
413.70g/mol
Molar mass
413.6960g/mol
Density
1.2143g/cm3
Appearence

The compound is typically a solid at room temperature, generally appearing as a crystalline powder. Its color can range from white to off-white, depending on the purity and specific physical form of the compound.

Comment on solubility

Solubility Insights

The solubility of (4-methyl-1,4-diazepane-1-carbothioyl)sulfanyl 4-methyl-1,4-diazepane-1-carbodithioate is influenced by several factors, given its unique molecular structure. Here are some key considerations:

  • Polarity: This compound contains multiple functional groups which may affect its overall polarity. Generally, compounds with higher polarity tend to have better solubility in polar solvents, such as water.
  • Hydrogen Bonding: The presence of sulfur atoms and potential hydrogen bond donors in the diazepane structure may enhance solubility in polar solvents.
  • Solvent Compatibility: It is likely to be more soluble in organic solvents like methanol, ethanol, or dichloromethane due to its hydrophobic characteristics.
  • Temperature Effects: Like many chemical compounds, an increase in temperature may improve solubility by providing the energy needed to overcome intermolecular forces.

In summary, while there is no definitive solubility data for this specific compound, it is reasonable to expect that it may have variable solubility in different solvents. This highlights the importance of conducting solubility experiments under varied conditions to determine the most suitable application environment.

Interesting facts

Interesting Facts about (4-methyl-1,4-diazepane-1-carbothioyl)sulfanyl 4-methyl-1,4-diazepane-1-carbodithioate

(4-methyl-1,4-diazepane-1-carbothioyl)sulfanyl 4-methyl-1,4-diazepane-1-carbodithioate is a fascinating compound that opens up the exploration of various chemical applications and physiological effects. This compound belongs to the class of thioesters, containing sulfur atoms within its structure which imparts unique properties.

Key Features

  • Synthesis: The synthesis of such compounds can involve various methods, particularly condensation reactions, which highlight the reactivity of the thiol and amine functional groups.
  • Biological Relevance: Compounds similar to this have been studied for their potential biological activities, including antimicrobial and antifungal properties. They could offer a basis for developing new pharmaceuticals.
  • Structural Insights: The presence of the diazepane ring in the structure is significant, as cyclic compounds often demonstrate interesting mechanisms of action and stability, making them suitable for drug delivery systems.
  • Versatile Reactions: The thiol groups present can engage in a variety of chemical reactions, such as nucleophilic substitutions and redox reactions, making them versatile building blocks in organic synthesis.

As the field of chemistry continues to unveil the myriad roles of sulfur-containing compounds, (4-methyl-1,4-diazepane-1-carbothioyl)sulfanyl 4-methyl-1,4-diazepane-1-carbodithioate stands out as a noteworthy candidate for further investigation. It embodies the intricate beauty of chemical structures and their potential impacts on both synthetic methodologies and biological processes.

Synonyms
26087-98-9
Fla 63
FLA-63
6XX8M7P9DC
DTXSID00180715
1H-1,4-Diazepine, 1,1'-(dithiodicarbonothioyl)bis(hexahydro-4-methyl-
DISULFIDE, BIS((HEXAHYDRO-4-METHYL-1H-1,4-DIAZEPIN-1-YL)THIOCARBONYL)
1H-1,4-Diazepine, 1,1'-(dithiodicarbonothioyl)bis[hexahydro-4-methyl-
RefChem:908324
DTXCID40103206
247-450-6
Bis((hexahydro-4-methyl-1H-1,4-diazepin-1-yl)thiocarbonyl)disulfide
bis-(4-Methyl-1-homopiperazinylthiocarbonyl)disulfide
(4-methyl-1,4-diazepane-1-carbothioyl)sulfanyl 4-methyl-1,4-diazepane-1-carbodithioate
Bis(4-methyl-1-homopiperazinylthiocarbonyl) disulfide
1H-1,4-Diazepine, 1,1'-(dithiodicarbonothioyl)bis[hexahydro-4-methyl- (9CI)
EINECS 247-450-6
UNII-6XX8M7P9DC
BRN 0561859
Bis(4-Methyl-1-Homopiperazinylthiocarbonyl)disulfide
Bis(4-methyl-4-aza-1,1-hexamethylene)thiuram disulphide
BIS(4-METHYL-1-HOMOPIPERAZINYL THIO CARBONYL)-DISULFIDE
orb1739912
SCHEMBL1195559
1H-1,4-Diazepine, 1,1'-(dithiodicarbonothioyl)bis(hexahydro-4-methyl)
AKOS030239792
DB-046829
Bis(4-methyl-1,4-diazepan-1-yl)dithioperoxyanhydride
bis-(4-methyl-1-homopiperazinylthiocarbonyl)-disulfide
Q27265691
Bis(4-methyl-1,4-diazepan-1-yl)dithioperoxyanhydride #