Banoxantrone
TL;DR: Banoxantrone (CAS 136470-65-0) is a chemical compound with molecular formula C22H28N4O6 and molecular weight 444.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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)
| Molecular Formula | C22H28N4O6 |
|---|---|
| Molecular Weight | 444.20 g/mol |
| LogP | 1.8454 |
| Topological Polar Surface Area | 144.78 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 444.2009 |
| Heavy Atoms | 32 |
| Complexity | 985.5566 |
Chemical Identifiers
| CAS Number | 136470-65-0 |
|---|---|
| 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-] |
Product Overview
Banoxantrone (CAS 136470-65-0), with molecular formula C22H28N4O6 and molecular weight 444.20 g/mol. IUPAC: 2-[[4-[2-[dimethyl(oxido)azaniumyl]ethylamino]-5,8-dihydroxy-9,10-dioxoanthracen-1-yl]amino]-N,N-dimethylethanamine oxide.
Chemical Property Profile of Banoxantrone
Property Insights of Banoxantrone
The XLogP value of 1.8454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Banoxantrone. The TPSA of 144.78 Ų indicates high polarity, suggesting Banoxantrone may have limited membrane permeability but good aqueous solubility. 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
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 444.20 g/mol.
Where can I buy Banoxantrone?
You can request a quote for Banoxantrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Banoxantrone?
Yes, KEHONG BIO provides custom synthesis services for Banoxantrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.