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ThioTEPA

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Identification
Molecular formula
C6H12N3O2P1S1
CAS number
52-24-4
IUPAC name
N-[bis(aziridin-1-yl)phosphoryl]-N-ethyl-1,3,4-thiadiazol-2-amine
State
State

At room temperature, ThioTEPA is typically in a solid state, presenting as a crystalline solid.

Melting point (Celsius)
52.00
Melting point (Kelvin)
325.15
Boiling point (Celsius)
320.00
Boiling point (Kelvin)
593.15
General information
Molecular weight
189.20g/mol
Molar mass
189.2000g/mol
Density
1.2620g/cm3
Appearence

ThioTEPA appears as a white crystalline solid. It is often described as having a characteristic crystalline structure, and it may lack color or be slightly off-white when pure.

Comment on solubility

Solubility of N-[bis(aziridin-1-yl)phosphoryl]-N-ethyl-1,3,4-thiadiazol-2-amine

The solubility of N-[bis(aziridin-1-yl)phosphoryl]-N-ethyl-1,3,4-thiadiazol-2-amine can be quite complex, owing to its unique chemical structure that incorporates multiple functional groups. This compound features both nitrogen-containing heterocycles and phosphorus, which significantly influence its interactions with solvents.

In general, solubility can be affected by various factors, and for this compound, we can consider:

  • Polarity: The presence of nitrogen and phosphorus suggests that the compound may have polar characteristics, potentially making it soluble in polar solvents such as water or alcohols.
  • Hydrogen Bonding: The ability to form hydrogen bonds may enhance solubility in protic solvents, offering an avenue for better solubilization.
  • Specific Solvent Compatibility: It may display varying degrees of solubility in organic solvents, necessitating experimentation to determine optimal conditions.

It is essential to note that for practical applications, solubility testing in various solvents is critical. Adopt a systematic approach to evaluate its solubility:
1. Start with **water** and **alcohols**.
2. Explore **organic solvents** like **DMSO** and **acetone**.
3. Assess the solubility at different **temperatures** to determine any temperature-dependent behavior.

Understanding the solubility of this compound is critical for its application in various fields, including pharmaceuticals and materials science. As always, "solubility is a key to understanding reactivity." Thus, detailed solubility studies are recommended for practical utilization.

Interesting facts

Interesting Facts about N-[bis(aziridin-1-yl)phosphoryl]-N-ethyl-1,3,4-thiadiazol-2-amine

N-[bis(aziridin-1-yl)phosphoryl]-N-ethyl-1,3,4-thiadiazol-2-amine is a fascinating compound that has applications spanning from medicinal chemistry to materials science. Here are some captivating points about it:

  • Unique Structural Features: This compound features a dual aziridine moiety, which is known for its ability to participate in various chemical reactions. This makes it a potential candidate for creating more complex molecular architectures.
  • Phosphoryl Group: The phosphoryl moiety in the compound can enhance its biological activity and resistance to enzymatic degradation, making it useful in pharmaceutical applications.
  • Thiadiazole Ring: The 1,3,4-thiadiazole structure is recognized for its diverse biological functions, such as antimicrobial and anti-inflammatory properties, which could lead to innovative drug design.
  • Potential Anti-Cancer Properties: Some studies suggest that compounds containing aziridine and thiadiazole units exhibit cytotoxic effects against various cancer cell lines, marking them as potential candidates in cancer therapy.
  • Versatile Applications: Beyond pharmaceuticals, this compound could be considered for applications in the development of advanced materials due to its unique chemical properties.

As a scientist examining the properties of this compound, one may also consider its synthesis and reactivity in different environments, contributing to the ongoing research in sustainable chemistry and material innovation.

The multidimensional nature of N-[bis(aziridin-1-yl)phosphoryl]-N-ethyl-1,3,4-thiadiazol-2-amine truly exemplifies how diverse chemical compounds can lead to groundbreaking advancements across multiple scientific domains.

Synonyms
AZETEPA
Azatepa
125-45-1
Azatepum
CL 25477
Thiatriamide
NSC-64826
D57I4Z650L
CL-25477
Phosphinic amide, P,P-bis(1-aziridinyl)-N-ethyl-N-1,3,4-thiadiazol-2-yl-
DTXSID10154543
NSC64826
RefChem:916592
DTXCID3077034
Azatep
Azetepa [USAN]
Aza TEPA
Azatepa [INN]
N-[bis(aziridin-1-yl)phosphoryl]-N-ethyl-1,3,4-thiadiazol-2-amine
Azatep; CL 25477; NSC-64826
P,P-Bis(1-aziridinyl)-N-ethyl-N-1,3,4-thiadiazol-2-ylphosphinic amide
Azatepum [INN-Latin]
Azetepa (USAN/INN)
UNII-D57I4Z650L
NSC 64826
AZATEPA [WHO-DD]
SCHEMBL4557
CHEMBL474928
CHEBI:177509
P,3,4-thiadiazol-2-ylphosphinic amide
NS00122048
D03036
Q27276113
Phosphinic amide,P-bis(1-aziridinyl)-N-ethyl-N-(1,3,4-thiadiazol-2-yl)-
Phosphinic amide,P-bis(1-aziridinyl)-N-ethyl-N-1,3,4-thiadiazol-2-yl-