Mitoxantrone Hydrochloride
TL;DR: Mitoxantrone Hydrochloride (CAS 70476-82-3) is a chemical compound with molecular formula C22H30Cl2N4O6 and molecular weight 516.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione;dihydrochloride
Also Known As: Mitoxantrone hydrochloride, Mitoxantrone dihydrochloride, Mitoxantrone HCl, mitoxantrone, Novantrone
| Molecular Formula | C22H30Cl2N4O6 |
|---|---|
| Molecular Weight | 516.15 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 516.15424 |
| Heavy Atoms | 34 |
| Complexity | 571.0 |
| Melting Point | 203-5 °C |
| Solubility | Sparingly soluble in water; slightly sol in methanol; practically insoluble in acetonitrile chloroform; acetone |
Chemical Identifiers
| CAS Number | 70476-82-3 |
|---|---|
| SMILES | C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO.Cl.Cl |
| InChIKey | ZAHQPTJLOCWVPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mitoxantrone Hydrochloride (CAS 70476-82-3), with molecular formula C22H30Cl2N4O6 and molecular weight 516.15 g/mol. IUPAC: 1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione;dihydrochloride.
Chemical Property Profile of Mitoxantrone Hydrochloride
Property Insights of Mitoxantrone Hydrochloride
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mitoxantrone Hydrochloride. The TPSA of 163.0 Ų indicates high polarity, suggesting Mitoxantrone Hydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mitoxantrone Hydrochloride has 10 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mitoxantrone Hydrochloride?
The CAS number of Mitoxantrone Hydrochloride is 70476-82-3.
What is the molecular formula of Mitoxantrone Hydrochloride?
The molecular formula of Mitoxantrone Hydrochloride is C22H30Cl2N4O6.
What is the molecular weight of Mitoxantrone Hydrochloride?
The molecular weight of Mitoxantrone Hydrochloride is 516.15 g/mol.
Where can I buy Mitoxantrone Hydrochloride?
You can request a quote for Mitoxantrone Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mitoxantrone Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Mitoxantrone Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.