N-[(2R)-2-(benzylamino)-1-hydroxyethyl]-N-tert-butyl-N-methylsulfonyl-2-naphthalenylpropanamide

Identification

Molecular formula

C₂₈H₃₆N₂O₄

CAS number

648447-16-5

IUPAC name

N-(1-benzyl-2-hydroxy-ethyl)-2-[[2-(tert-butylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]-3-methyl-butanamide

State

At room temperature, this compound is in the form of a solid, specifically a white to off-white crystalline powder. It is typically stable under standard conditions.

Melting point (Celsius)

145.00

Melting point (Kelvin)

418.15

Boiling point (Celsius)

220.00

Boiling point (Kelvin)

493.15

General information

Molecular weight

503.68g/mol

Molar mass

503.6750g/mol

Density

1.2030g/cm³

Appearence

This compound typically appears as a white to off-white crystalline powder. The appearance can vary slightly based on the specific purity and sample form.

Comment on solubility

Solubility of N-(1-benzyl-2-hydroxy-ethyl)-2-[[2-(tert-butylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]-3-methyl-butanamide

The solubility characteristics of the compound N-(1-benzyl-2-hydroxy-ethyl)-2-[[2-(tert-butylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]-3-methyl-butanamide (C₂₈H₃₆N₂O₄) are intricate and can be influenced by multiple factors. Here are some key points regarding its solubility:

Polarity: The presence of both hydrophobic naphthyl groups and polar hydroxyl functions suggests varying degrees of solubility in different solvents.
Solvent Interaction: This compound is likely to be more soluble in organic solvents such as ethanol, methanol, and dimethyl sulfoxide (DMSO) due to its structural features.
Water Solubility: Given the bulky tert-butylsulfonylmethyl group and the overall complexity of the structure, water solubility may be limited. It might show some level of solubility, but exact values depend on conditions.
Temperature Influence: An increase in temperature typically enhances solubility for many organic compounds, which could also apply to this compound.

In summary, while specific solubility data for this compound may not be readily available, its amphipathic nature hints that it could potentially dissolve well in organic media, yet may exhibit limited solubility in aqueous environments. Further empirical studies are recommended to explore its solubility profile under various conditions.

Interesting facts

Interesting Facts about N-(1-benzyl-2-hydroxy-ethyl)-2-[[2-(tert-butylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]-3-methyl-butanamide

N-(1-benzyl-2-hydroxy-ethyl)-2-[[2-(tert-butylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]-3-methyl-butanamide is a fascinating compound with a rich array of properties and potential applications. Below are some notable features and insights regarding this chemical:

Complex Structure: This compound boasts a multifaceted molecular structure, which includes multiple functional groups such as hydroxy, sulfonyl, and amide groups. Such complexity often translates into interesting interactions in biological systems.
Potential Biological Activity: Compounds with similar structures have been investigated for their biological activities, including anti-inflammatory and analgesic properties. Researchers are particularly interested in how this compound's unique substitutions might influence its activity.
Drug Development: The incorporation of substituents like the tert-butylsulfonylmethyl and naphthyl groups may confer desirable pharmacokinetic properties, which are essential in the design of new pharmaceuticals. This hints at its potential use as a therapeutic agent.
Structure-Activity Relationship (SAR): Understanding how variations in the chemical structure affect the biological activity is key in medicinal chemistry. This compound provides an excellent case study for SAR analysis, as slight modifications can lead to significant changes in efficacy.
Research Potential: This compound is a candidate for further research and can be utilized in various fields, including medicinal chemistry, pharmacology, and organic synthesis. Its synthesis and characterization could yield important insights into similar compounds.

Overall, N-(1-benzyl-2-hydroxy-ethyl)-2-[[2-(tert-butylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]-3-methyl-butanamide exemplifies the intricate relationship between chemical structure and function that continues to drive innovation in the field of chemistry.