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Clomipramine

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Identification
Molecular formula
C19H23ClN3S
CAS number
303-49-1
IUPAC name
7-(2-chlorophenyl)-4-ethyl-13-methyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaene
State
State

At room temperature, clomipramine typically exists as a solid.

Melting point (Celsius)
191.00
Melting point (Kelvin)
464.15
Boiling point (Celsius)
544.00
Boiling point (Kelvin)
817.15
General information
Molecular weight
314.88g/mol
Molar mass
314.8810g/mol
Density
1.3070g/cm3
Appearence

Clomipramine is usually presented as a white to slightly yellow crystalline powder. It is often provided in a formulated form such as tablets or capsules for medical use.

Comment on solubility

Solubility of 7-(2-chlorophenyl)-4-ethyl-13-methyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaene

The solubility of the compound with the formula C19H23ClN3S presents an intriguing profile due to its structural complexity and functional groups. Factors influencing its solubility can include:

  • Polarity: The presence of the chlorine atom and multiple nitrogen atoms may contribute to polarity, which typically enhances solubility in polar solvents.
  • Hydrophobic and Hydrophilic Interactions: With a notable hydrophobic carbon skeleton contrasted by potentially polar functional groups, this compound may exhibit mixed solubility behaviors.
  • Temperature Dependency: Solubility can vary significantly with temperature changes, often increasing in warmer solvents.
  • pH Sensitivity: Given the nitrogen atoms, solubility might also be influenced by the pH of the solution, impacting protonation states.

In practical applications, the solubility of this compound could be significant for its formulation in various environments. For example, as referenced, many compounds with intricate structures tend to show solubility in organic solvents such as dimethyl sulfoxide (DMSO) or ethanol. However, it may not be soluble in water due to its large non-polar regions and hydrophobic character.

In conclusion, while the direct measurement of its solubility would provide precise insights, understanding the various influencing factors allows for predictive assessments regarding its behavior in different solvent environments.

Interesting facts

Interesting Facts about 7-(2-chlorophenyl)-4-ethyl-13-methyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaene

This compound, with its complex structure, exemplifies the intricate world of organic chemistry. Here are some fascinating insights:

  • Unique Structure: The name reveals a highly substituted tricyclic framework, showcasing a tetrazatricyclo configuration. This level of structural complexity opens up various avenues for research and application in medicinal chemistry.
  • Chlorine Influence: The presence of a chlorophenyl group indicates potential biological activity. Chlorine substituents are known to enhance the compound's lipophilicity, which can improve its interaction with biological membranes and affect its pharmacological properties.
  • Sulfur's Role: With a thioether component in its structure, the sulfur atom can impart distinctive reactivity and biological properties. Sulfur-containing compounds are often found in nature and are critical in various enzymatic processes.
  • Applications: Due to its structure, this compound could have potential applications in fields like pharmaceuticals and agrochemicals. Its unique formula could pave the way for developing new therapeutic agents.
  • Research Potential: The intricate nature of this compound encourages scientists to explore its synthesis, properties, and functional applications, which could contribute to advancements in chemical research.

As with many chemical compounds, understanding its properties and how they can be utilized is crucial. This compound's fascinating configuration not only highlights the complexity within organic chemistry but also its potential for innovation in various scientific fields.

Synonyms
etizolam
40054-69-1
Depas
Etizolamum
Sedekopan
Etizolam [INN:JAN]
Etizolamum [INN-Latin]
Y-7131
AHR 3219
4-(2-chlorophenyl)-2-ethyl-9-methyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine
Sedekopan (TN)
BRN 0572740
A76XI0HL37
DTXSID0023030
ETIZOLAM [INN]
ETIZOLAM [JAN]
ETIZOLAM [MI]
ETIZOLAM [MART.]
ETIZOLAM [WHO-DD]
4-(o-Chlorophenyl)-2-ethyl-9-methyl-6H-thieno(3,2-f)-s-triazolo(4,3-a)(1,4)diazepine
DTXCID203030
6-(o-Chlorophenyl)-8-ethyl-1-methyl-4H-s-triazolo(3,4-c)thieno(2,3-e)(1,4)-diazepine
6-(o-Chlorphenyl)-8-aethyl-1-methyl-4H-s-triazolo(3,4-c)thieno(2,3-e)(1,4)diazepin [German]
6H-Thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepine, 4-(2-chlorophenyl)-2-ethyl-9-methyl-
8-Ethyl-6-(o-chlorophenyl)-1-methyl-4H-s-triazolo(3,4c)thieno(2,3e)-1,4-diazepine
NCGC00182031-01
Etizolamum (INN-Latin)
ETIZOLAM (MART.)
4H-s-Triazolo(3,4-c)thieno(2,3-e)(1,4)-diazepine, 6-(o-chlorophenyl)-8-ethyl-1-methyl-
6-(o-Chlorphenyl)-8-aethyl-1-methyl-4H-s-triazolo(3,4-c)thieno(2,3-e)(1,4)diazepin
7-(2-chlorophenyl)-4-ethyl-13-methyl-3-thia-1,8,11,12-tetraazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,7,10,12-pentaene
Etizolam (1.0 mg/mL in Methanol)
7-(2-Chlorophenyl)-4-ethyl-13-methyl-3-thia-1,8,11,12-tetraazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaene
Y 7131
UNII-A76XI0HL37
1-Methyl-6-o-chlorophenyl-8-ethyl-4H-s-triazolo(3,4-c)thieno(2,3-e)1,4-diazepine
1-methyl-6-o-chlorophenyl-8-ethyl-4h-s-triazolo[3,4-c]thieno[2,3-e]1,4-diazepine
4-(2-Chlorophenyl)-2-ethyl-9-methyl-6H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepine
4-(2-Chlorophenyl)-2-ethyl-9-methyl-6H-thieno(3,2-f)(1,2,4)triazolo(4,3a)(1,4)diazepine
4-(2-Chlorophenyl)-2-ethyl-9-methyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3a][1,4]diazepine
6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine, 4-(2-chlorophenyl)-2-ethyl-9-methyl-; AHR 3219; Depas; Etizolam; Y 7131
7-(2-chlorophenyl)-4-ethyl-13-methyl-3-thia-1,8,11,12-tetraazatricyclo(8.3.0.0^(2,6))trideca-2(6),4,7,10,12-pentaene
7-(2-chlorophenyl)-4-ethyl-13-methyl-3-thia-1,8,11,12-tetraazatricyclo(8.3.0.02,6)trideca-2(6),4,7,10,12-pentaene
AHR3219;Y7131
Etizolam (JP18/INN)
SCHEMBL42920
Etizolam, 1mg/ml in Methanol
CHEMBL1289779
CHEBI:31583
AHR3219
Etizolam 0.1 mg/ml in Methanol
Etizolam 1.0 mg/ml in Methanol
N05BA19
4c66
DEA NO. 2780
HMS3652N06
BCP22893
HY-B0677
Tox21_112931
s4276
AKOS022185397
DB09166
DS-3112
NCGC00182031-05
CAS-40054-69-1
NS00098696
SW219903-1
D01514
Q409966
SR-01000883960
SR-01000883960-1
BRD-K68232413-001-01-2
4-(2-Chlorophenyl)-2-ethyl-9-methyl-6H-thieno[3,2-f] [1,2,4]triazolo[4,3-a] [1,4]diazepine
4-(2-chlorophenyl)-2-ethyl-9-methyl-6H-thieno[3,2-f][1,2,4]-triazolo[4,3-a][1,4]diazepine
662-368-4
7-(2-chlorophenyl)-4-ethyl-13-methyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaene
H4C