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Modafinil

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Identification
Molecular formula
C15H15NO2S
CAS number
68693-11-8
IUPAC name
2-[(4-butylsulfanylphenyl)-phenyl-methyl]sulfanyl-N,N-dimethyl-ethanamine
State
State

Modafinil is in a solid state at room temperature, appearing as a crystalline powder.

Melting point (Celsius)
159.70
Melting point (Kelvin)
432.80
Boiling point (Celsius)
525.40
Boiling point (Kelvin)
798.60
General information
Molecular weight
273.38g/mol
Molar mass
273.3830g/mol
Density
1.1900g/cm3
Appearence

Modafinil is a white to off-white, crystalline powder with a slight sulfurous odor. It is practically insoluble in water and cyclohexane, but sparingly soluble in acetone and soluble in methanol and ethanol.

Comment on solubility

Solubility of 2-[(4-butylsulfanylphenyl)-phenyl-methyl]sulfanyl-N,N-dimethyl-ethanamine

The solubility of 2-[(4-butylsulfanylphenyl)-phenyl-methyl]sulfanyl-N,N-dimethyl-ethanamine can be influenced by several factors, including its chemical structure and the polarity of its functional groups. This compound exhibits a unique molecular configuration due to the presence of both sulfanyl and dimethylamino groups, which can lead to intriguing solubility characteristics.

  • Polarity: The presence of polar functional groups, such as the dimethylamino group, typically enhances solubility in polar solvents, such as water.
  • Hydrophobic Interactions: The butylsulfanyl moiety may impart hydrophobic properties that can limit solubility in aqueous environments.
  • Solvent Compatibility: This compound may have better solubility in organic solvents, such as ethanol and acetone, due to its hydrophobic characteristics.

As a general comment, compounds that contain a balance of polar and non-polar regions often exhibit a complicated solubility profile. Therefore, experimental evaluation is essential to fully understand the solubility behavior of 2-[(4-butylsulfanylphenyl)-phenyl-methyl]sulfanyl-N,N-dimethyl-ethanamine in various mediums.

For anyone attempting to utilize this compound in synthesis or analysis, it is crucial to consider these solubility factors to achieve optimal results.

Interesting facts

Exploring 2-[(4-butylsulfanylphenyl)-phenyl-methyl]sulfanyl-N,N-dimethyl-ethanamine

This compound, with its complex name, is intriguing for several reasons. **Small molecule** compounds like this one often play pivotal roles in chemical research and development, particularly in the fields of pharmaceuticals and organic synthesis. Here are some fascinating points to consider:

  • Substituted Phenyl Structures: The presence of multiple phenyl (benzene) rings contributes to robust *aromaticity*, which enhances the stability of the compound. Aromatic compounds are widely recognized for their varied roles in biological systems.
  • Sulfanyl Groups: The thiol (-SH) functionalities can engage in various chemical reactions, making sulfanyl-containing compounds valuable in organic chemistry and medicinal chemistry.
  • Potential Applications: Compounds like this can serve as potential *ligands* or intermediates in the synthesis of biologically active molecules, potentially leading to the development of new antimicrobial or anticancer agents.
  • Structure-Activity Relationship (SAR): Understanding how different substituents on the phenyl rings influence biological activity can help chemists design more potent compounds with fewer side effects.

In the words of renowned chemist, Marie Curie, *"One never notices what has been done; one can only see what remains to be done."* This quote is particularly relevant as chemists continue to explore the myriad possibilities that compounds like this hold within the vast landscape of chemical research.

Overall, 2-[(4-butylsulfanylphenyl)-phenyl-methyl]sulfanyl-N,N-dimethyl-ethanamine exemplifies the intricate interplay of *structure and function* in chemical compounds. Its unique substituents and potential applications make it a point of interest for both theoretical studies and practical applications in chemical sciences.

Synonyms
Captodiame
Captodiamine
486-17-9
Captodiamin
Captodramin
Captodramine
Covatin
Captodiam
Captodiamo
Kaptodiamin
Captodiamum
Kaptodiamin [Czech]
Captodiame [INN:BAN]
Captodiamum [INN-Latin]
Captodiamo [INN-Spanish]
VUFB2350
EINECS 207-629-1
Captodiame (BAN)
UNII-H93K9455DD
BRN 2625367
Suvren (Salt/Mix)
CAPTODIAME [INN]
CAPTODIAMINE [MI]
CAPTODIAME [WHO-DD]
p-Butylmercaptobenzhydryl-beta-dimethylamino-ethylsulphide
VUFB 2350
DTXSID50862014
4-06-00-06672 (Beilstein Handbook Reference)
Captodiamum (INN-Latin)
Ethanamine, 2-(((4-(butylthio)phenyl)phenylmethyl)thio)-N,N-dimethyl-
Ethanamine, 2-[[[4-(butylthio)phenyl]phenylmethyl]thio]-N,N-dimethyl-
Captodiamo (INN-Spanish)
ETHYLAMINE, 2-((p-(BUTYLTHIO)-alpha-PHENYLBENZYL)THIO)-N,N-DIMETHYL-
p-Butylthiodiphenylmethyl 2-(dimethylamino)ethyl sulfide
BUTYLTHIODIPHENYLMETHYL 2-DIMETHYLAMINOETHYL SULFIDE
p-Butylmercaptobenzhydryl .beta.-dimethylaminoethyl sulfide
p-Butylmercaptobenzhydryl-.beta.-dimethylamino-ethylsulphide
P-BUTYLTHIODIPHENYLMETHYL 2-DIMETHYLAMINOETHYL SULFIDE
P-BUTYLTHIODIPHENYLMETHYL 2-DIMETHYLAMINOETHYL SULPHIDE
2-(P-(BUTYLTHIO)-.ALPHA.-PHENYLBENZYLTHIO)-N,N-DIMETHYLETHYLAMINE
2-[(4-butylsulfanylphenyl)-phenyl-methyl]sulfanyl-N,N-dimethylethanamine
Ethylamine, 2-[[p-(butylthio)-.alpha.-phenylbenzyl]thio]-N,N-dimethyl-
ETHYLAMINE, 2-((P-(BUTYLTHIO)-.ALPHA.-PHENYLBENZYL)THIO)-N,N-DIMETHYL-
(2-(((4-(butylsulfanyl)phenyl)(phenyl)methyl)sulfanyl)ethyl)dimethylamine
[2-({[4-(butylsulfanyl)phenyl](phenyl)methyl}sulfanyl)ethyl]dimethylamine
2-((4-butylsulfanylphenyl)-phenyl-methyl)sulfanyl-N,N-dimethylethanamine
DTXCID70810850
p-Butylmercaptobenzhydryl beta-dimethylaminoethyl sulfide
2-(P-(BUTYLTHIO)-ALPHA-PHENYLBENZYLTHIO)-N,N-DIMETHYLETHYLAMINE
Ethanamine, 2-(((4-(butylthio)phenyl)phenylmethyl)thio)-N,N-dimethyl-(9CI)
207-629-1
izlpzxszllelbj-uhfffaoysa-n
N 68
H93K9455DD
2-[(4-butylsulfanylphenyl)-phenylmethyl]sulfanyl-N,N-dimethylethanamine
Captodiamin; Captodiamine; Captodramin; Captodramine; Covatin
Ethanamine, 2-(((4-(butylthio)phenyl)phenylmethyl)thio)-N,N-dimethyl- (9CI)
starbld0009544
2-((p-(Butylthio)-alpha-phenylbenzyl)thio)-N,N-dimethylethylamine
SCHEMBL466131
CHEMBL2110809
CHEBI:135521
AKOS040745647
DB09014
NS00007522
D07316
Q2937681
2-((p-(Butylthio)-.alpha.-phenylbenzyl)thio)-N,N-dimethylethylamine
N-(2-([[4-(Butylsulfanyl)phenyl](phenyl)methyl]sulfanyl)ethyl)-N,N-dimethylamine #
N-(2-{[[4-(butylsulfanyl)phenyl](phenyl)methyl]sulfanyl}ethyl)-N,N-dimethylamine