Banoxantrone
TL;DR: Banoxantrone (CAS 136470-65-0) is a chemical compound with molecular formula C22H28N4O6 and molecular weight 444.2009 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[4-[2-[dimethyl(oxido)azaniumyl]ethylamino]-5,8-dihydroxy-9,10-dioxoanthracen-1-yl]amino]-N,N-dimethylethanamine oxide
Also Known As: Banoxantrone, banoxantrona, AQ4N, banoxantronum, Banoxantrone (AQ4N)
Technical Specifications
| Molecular Formula | C22H28N4O6 |
| Molecular Weight | 444.2009 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 444.2009 Da |
| Heavy Atoms | 32 |
| Complexity | 644.0 |
| SMILES | C[N+](C)(CCNC1=C2C(=C(C=C1)NCC[N+](C)(C)[O-])C(=O)C3=C(C=CC(=C3C2=O)O)O)[O-] |
| InChIKey | YZBAXVICWUUHGG-UHFFFAOYSA-N |
Chemical Property Profile of Banoxantrone
Property Insights of Banoxantrone
The XLogP value of 3.3 indicates that Banoxantrone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Banoxantrone. Following Lipinski's Rule of Five, Banoxantrone has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Banoxantrone?
The CAS number of Banoxantrone is 136470-65-0.
What is the molecular formula of Banoxantrone?
The molecular formula of Banoxantrone is C22H28N4O6.
What is the molecular weight of Banoxantrone?
The molecular weight of Banoxantrone is 444.2009 g/mol.
Where can I buy Banoxantrone?
You can request a quote for Banoxantrone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Banoxantrone?
Yes, CoreyChem provides custom synthesis services for Banoxantrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.