CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | Water > 100 (mg/mL) |
|---|---|
| Stability/Shelf Life | Bulk: The sample is stable at room temperature for at least one month (HPLC). Solution: As a 10% solution in water, the chemical is stable for at least 24 hours (HPLC). |
COMPUTED DESCRIPTORS
| Molecular Weight | 214.18 g/mol |
|---|---|
| XLogP3 | -1.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 214.07020481 g/mol |
| Monoisotopic Mass | 214.07020481 g/mol |
| Topological Polar Surface Area | 113 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 242 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Etanidazole is a monocarboxylic acid amide obtained by formal condensation of the carboxy group of (2-nitro-1H-imidazol-1-yl)acetic acid with the amino group of ethanolamine. Used as a radiosensitising agent for hypoxic tumour cells. It has a role as an antineoplastic agent, a prodrug, an alkylating agent and a radiosensitizing agent. It is a member of imidazoles, a C-nitro compound and a monocarboxylic acid amide. It is functionally related to an ethanolamine.