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5-Nitro-2,4-Dichloropyrimidine as an Universal Model for Low-Energy Electron Processes Relevant for Radiosensitization
- Source :
- International Journal of Molecular Sciences, International Journal of Molecular Sciences, Vol 21, Iss 8173, p 8173 (2020), Volume 21, Issue 21
- Publication Year :
- 2020
-
Abstract
- We report experimental results of low-energy electron interactions with 5-nitro-2,4-dichloropyrimidine isolated in the gas phase and hydrated in a cluster environment. The molecule exhibits a very rare combination of many so far hypothesized low-energy electron induced mechanisms, which may be responsible for synergism in concurrent chemo-radiation therapy of cancer. In contrast to many previous efforts to design an ideal radiosensitizer based on one mode of action, the present model molecule presents an alternative approach, where several modes of action are combined. With respect to the processes induced by the low-energy electrons, this is not a trivial task because of strong bond specificity of the dissociative electron attachment reaction, as it is discussed in the present paper. Unfortunately, low solubility and high toxicity of the molecule, as obtained from preliminary MTT assay tests, do not enable further studies of its activity in real biological systems but it can advantageously serve as a model or a base for rational design of radiosensitizers.
- Subjects :
- Models, Molecular
Radiosensitizer
Radiation-Sensitizing Agents
pyrimidine
Electrons
Electron
010402 general chemistry
01 natural sciences
Catalysis
Article
Inorganic Chemistry
lcsh:Chemistry
Computational chemistry
Cell Line, Tumor
Radiation, Ionizing
Cluster (physics)
Molecule
Humans
MTT assay
Physical and Theoretical Chemistry
Solubility
Mode of action
Molecular Biology
lcsh:QH301-705.5
Spectroscopy
Hypopharyngeal Neoplasms
radiosensitizer
low-energy electrons
010405 organic chemistry
Chemistry
Squamous Cell Carcinoma of Head and Neck
Organic Chemistry
Rational design
General Medicine
Nitro Compounds
0104 chemical sciences
Computer Science Applications
Pyrimidines
lcsh:Biology (General)
lcsh:QD1-999
Models, Chemical
dissociative electron attachment
Subjects
Details
- ISSN :
- 14220067
- Volume :
- 21
- Issue :
- 21
- Database :
- OpenAIRE
- Journal :
- International journal of molecular sciences
- Accession number :
- edsair.doi.dedup.....0eaffd44a2582fcdb05059c9c9ad8563