Ametantrone acetate
TL;DR: Ametantrone acetate (CAS 70711-40-9) is a chemical compound with molecular formula C26H36N4O8 and molecular weight 532.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl-[2-[[4-[2-(2-hydroxyethylazaniumyl)ethylamino]-9,10-dioxoanthracen-1-yl]amino]ethyl]azanium diacetate
Also Known As: Ametantrone acetate, Ametantrone, ametantrone diacetate, Ametantrone acetate [USAN], CI 881
| Molecular Formula | C26H36N4O8 |
|---|---|
| Molecular Weight | 532.25 g/mol |
| LogP | -4.09 |
| Topological Polar Surface Area | 212.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 532.2533 |
| Heavy Atoms | 38 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 70711-40-9 |
|---|---|
| SMILES | CC(=O)[O-].CC(=O)[O-].C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCC[NH2+]CCO)NCC[NH2+]CCO |
| InChIKey | IGCAUIJHGNYDKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ametantrone acetate (CAS 70711-40-9), with molecular formula C26H36N4O8 and molecular weight 532.25 g/mol. IUPAC: 2-hydroxyethyl-[2-[[4-[2-(2-hydroxyethylazaniumyl)ethylamino]-9,10-dioxoanthracen-1-yl]amino]ethyl]azanium diacetate.
Chemical Property Profile of Ametantrone acetate
Property Insights of Ametantrone acetate
The XLogP value of -4.09 indicates that Ametantrone acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 212.0 Ų indicates high polarity, suggesting Ametantrone acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ametantrone acetate has 6 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 Ametantrone acetate?
The CAS number of Ametantrone acetate is 70711-40-9.
What is the molecular formula of Ametantrone acetate?
The molecular formula of Ametantrone acetate is C26H36N4O8.
What is the molecular weight of Ametantrone acetate?
The molecular weight of Ametantrone acetate is 532.25 g/mol.
Where can I buy Ametantrone acetate?
You can request a quote for Ametantrone acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ametantrone acetate?
Yes, KEHONG BIO provides custom synthesis services for Ametantrone acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.