31098-42-7
Product Name:
2-(3-aminopropylamino)ethanethiol
Formula:
C5H14N2S
Synonyms:
2-[(3-Aminopropyl)amino]ethanethiol dihydrochloride;WR-1065 dihydrochloride
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COMPUTED DESCRIPTORS
| Molecular Weight | 134.25 g/mol |
|---|---|
| XLogP3 | -0.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 134.08776963 g/mol |
| Monoisotopic Mass | 134.08776963 g/mol |
| Topological Polar Surface Area | 39 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 41.4 |
| 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
WR-1065 is an alkanethiol that is the N-3-aminopropyl derivative of cysteamine. Used as the S-phosphorylated prodrug, amifostine, for cytoprotection in cancer chemotherapy and radiotherapy. It has a role as a radiation protective agent, an antioxidant and a drug metabolite. It is a diamine and an alkanethiol. It is functionally related to a cysteamine.