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Identification
Molecular formula
C33H40N4O4S2
CAS number
N/A
IUPAC name
thiazol-5-ylmethyl N-[1-benzyl-2-hydroxy-4-[[2-[[(2-isopropylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoyl]amino]-5-phenyl-pentyl]carbamate
State
State
It is typically found in a solid state at room temperature.
Melting point (Celsius)
142.00
Melting point (Kelvin)
415.15
Boiling point (Celsius)
296.70
Boiling point (Kelvin)
569.85
General information
Molecular weight
626.83g/mol
Molar mass
626.8290g/mol
Density
1.2500g/cm3
Appearence
This compound typically appears as a white to off-white solid. It is often crystalline in nature.
Comment on solubility

Solubility of Thiazol-5-ylmethyl N-[1-benzyl-2-hydroxy-4-[[2-[[(2-isopropylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoyl]amino]-5-phenyl-pentyl]carbamate

The solubility of this complex compound, C33H40N4O4S2, can be influenced by a variety of factors, making it quite intriguing. It is important to consider the following:

  • Polarity: Due to the presence of both hydrophilic (e.g., hydroxyl and carbamate groups) and hydrophobic (e.g., phenyl and isopropyl groups) regions, the solubility can vary significantly in different solvents.
  • Solvent Interaction: The compound is likely to show better solubility in polar solvents, such as water or alcohols, compared to non-polar solvents due to interactions with the polar functional groups.
  • Temperature Dependence: Like many organic compounds, solubility may increase with temperature; hence, studying its solubility at various temperatures can yield insightful data.
  • pH Sensitivity: Since the compound has acidic and basic functional groups, its solubility may also be pH-dependent, highlighting the importance of conducting solubility tests across a range of pH levels.

In conclusion, while this compound may display appreciable solubility under the right conditions, the intricate balance of its structural elements necessitates thorough investigation to fully understand its behavior in solution. Thus, "the more you know, the more you grow" applies perfectly here in the context of solubility research.

Interesting facts

Interesting Facts about Thiazol-5-ylmethyl N-[1-benzyl-2-hydroxy-4-[[2-[[(2-isopropylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoyl]amino]-5-phenyl-pentyl]carbamate

This compound represents a fascinating intersection of organic chemistry and pharmacology, showcasing the intricate design of small molecules with potential therapeutic applications. Here are some intriguing aspects:

  • Complex Structure: The compound consists of multiple functional groups, including thiazole, carbamate, and hydrophobic alkyl chains, which contribute to its solubility and biological activity.
  • Potential Pharmacological Applications: Compounds with similar structures have shown promise in various therapeutic areas, particularly in targeting specific enzyme pathways, which could lead to new treatments for diseases.
  • Thiazole Ring System: The thiazole moiety is known for its significance in medicinal chemistry, particularly in developing antibiotics, antifungals, and anti-inflammatory drugs. Its heterocyclic nature allows for diverse interactions with biological targets.
  • Importance of Substitution Patterns: The unique substituents such as the hydroxy and benzyl groups could enhance the compound's interaction with biological receptors, making it an interesting subject for further studies.
  • Innovation in Drug Design: This compound exemplifies the creativity involved in drug design, merging various chemical components to optimize efficacy, reduce toxicity, and improve metabolic stability.

The complexity of this molecule illustrates the beauty of chemical synthesis and its potential to yield new medicinal breakthroughs. As researchers continue to explore compounds like this, we may uncover innovative solutions to challenging health issues.

Synonyms
162990-01-4
Ritonavir-13C3
1,3-thiazol-5-ylmethyl N-[3-hydroxy-5-[[3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate
N-[3-hydroxy-5-[[3-methyl-2-[[[methyl-[(2-propan-2-yl-4-thiazolyl)methyl]amino]-oxomethyl]amino]-1-oxobutyl]amino]-1,6-diphenylhexan-2-yl]carbamic acid 5-thiazolylmethyl ester
(1,3-Thiazol-5-yl)methyl N-[3-hydroxy-5-(3-methyl-2-{[methyl({[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl})carbamoyl]amino}butanamido)-1,6-diphenylhexan-2-yl]carbamate
Ritonavir?
1217673-23-8
SCHEMBL3178401
CHEMBL3182552
CHEBI:94317
DTXSID60861417
HMS3369I13
HMS3393B08
HMS3654E18
SYB67323
Thiazol-5-ylmethyl((2S,3R,5S)-3-hydroxy-5-((S)-2-(3-((2-isopropylthiazol-4-yl)methyl)-3-methylureido)-3-methylbutanamido)-1,6-diphenylhexan-2-yl)carbamate
SB19160
LS-15398
SY073242
A23572
EN300-296205
BRD-A03323675-001-01-2
Q27166137
(1,3-Thiazol-5-yl)methylN-[3-hydroxy-5-(3-methyl-2-{[methyl({[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl})carbamoyl]amino}butanamido)-1,6-diphenylhexan-2-yl]carbamate
5-Thiazolylmethyl [(2S,3S,5S)-3-Hydroxy-5-[(S)-2-[3-[(2-isopropyl-4-thiazolyl)methyl]-3-methylureido]-3-methylbutanamido]-1,6-diphenyl-2-hexyl]carbamate
N-[4-Hydroxy-1,6-diphenyl-5-({[(1,3-thiazol-5-yl)methoxy]carbonyl}amino)hexan-2-yl]-N~2~-(methyl{[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl}carbamoyl)valinamide