Rubiginone A2
TL;DR: Rubiginone A2 (CAS 96695-58-8) is a chemical compound with molecular formula C20H16O5 and molecular weight 336.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-8-methoxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione
Also Known As: Rubiginone A2, Fujianmycin B, 4-hydroxy-8-methoxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione
| Molecular Formula | C20H16O5 |
|---|---|
| Molecular Weight | 336.10 g/mol |
| LogP | 2.7265 |
| Topological Polar Surface Area | 80.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 336.09976 |
| Heavy Atoms | 25 |
| Complexity | 956.79913 |
Chemical Identifiers
| CAS Number | 96695-58-8 |
|---|---|
| SMILES | CC1CC(=O)C2=C(C1O)C=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)OC |
Product Overview
Rubiginone A2 (CAS 96695-58-8), with molecular formula C20H16O5 and molecular weight 336.10 g/mol. IUPAC: 4-hydroxy-8-methoxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione.
Chemical Property Profile of Rubiginone A2
Property Insights of Rubiginone A2
The XLogP value of 2.7265 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rubiginone A2. The TPSA of 80.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Rubiginone A2. Following Lipinski's Rule of Five, Rubiginone A2 has 1 hydrogen bond donor(s) and 5 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 Rubiginone A2?
The CAS number of Rubiginone A2 is 96695-58-8.
What is the molecular formula of Rubiginone A2?
The molecular formula of Rubiginone A2 is C20H16O5.
What is the molecular weight of Rubiginone A2?
The molecular weight of Rubiginone A2 is 336.10 g/mol.
Where can I buy Rubiginone A2?
You can request a quote for Rubiginone A2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rubiginone A2?
Yes, KEHONG BIO provides custom synthesis services for Rubiginone A2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.