Amifostine Trihydrate
TL;DR: Amifostine Trihydrate (CAS 112901-68-5) is a chemical compound with molecular formula C5H21N2O6PS and molecular weight 268.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-aminopropylamino)ethylsulfanylphosphonic acid;trihydrate
Also Known As: Amifostine trihydrate, amifostine, Ethyol, Amifostine hydrate, Anifostine trihydrate
| Molecular Formula | C5H21N2O6PS |
|---|---|
| Molecular Weight | 268.09 g/mol |
| LogP | -2.7234 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 268.0858 |
| Heavy Atoms | 15 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 112901-68-5 |
|---|---|
| SMILES | C(CN)CNCCSP(=O)(O)O.O.O.O |
| InChIKey | TXQPXJKRNHJWAX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Amifostine Trihydrate (CAS 112901-68-5), with molecular formula C5H21N2O6PS and molecular weight 268.09 g/mol. IUPAC: 2-(3-aminopropylamino)ethylsulfanylphosphonic acid;trihydrate.
Chemical Property Profile of Amifostine Trihydrate
Property Insights of Amifostine Trihydrate
The XLogP value of -2.7234 indicates that Amifostine Trihydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Amifostine Trihydrate. Following Lipinski's Rule of Five, Amifostine Trihydrate has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Amifostine Trihydrate?
The CAS number of Amifostine Trihydrate is 112901-68-5.
What is the molecular formula of Amifostine Trihydrate?
The molecular formula of Amifostine Trihydrate is C5H21N2O6PS.
What is the molecular weight of Amifostine Trihydrate?
The molecular weight of Amifostine Trihydrate is 268.09 g/mol.
Where can I buy Amifostine Trihydrate?
You can request a quote for Amifostine Trihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amifostine Trihydrate?
Yes, KEHONG BIO provides custom synthesis services for Amifostine Trihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.