Quercetagetin 3,4'-dimethyl ether
TL;DR: Quercetagetin 3,4'-dimethyl ether (CAS 59171-34-5) is a chemical compound with molecular formula C17H14O8 and molecular weight 346.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxychromen-4-one
Also Known As: Quercetagetin 3,4'-dimethyl ether, Quercetagetin-3,4'-dimethyl ether, Quercetagetin 3,4 -dimethyl ether, 5,6,7,3'-Tetrahydroxy-3,4'-dimethoxyflavone, J3.487.725D
| Molecular Formula | C17H14O8 |
|---|---|
| Molecular Weight | 346.07 g/mol |
| LogP | 2.2996 |
| Topological Polar Surface Area | 129.59 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.06888 |
| Heavy Atoms | 25 |
| Complexity | 1035.2229 |
Chemical Identifiers
| CAS Number | 59171-34-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C(=C3O)O)O)OC)O |
Product Overview
Quercetagetin 3,4'-dimethyl ether (CAS 59171-34-5), with molecular formula C17H14O8 and molecular weight 346.07 g/mol. IUPAC: 5,6,7-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxychromen-4-one.
Chemical Property Profile of Quercetagetin 3,4'-dimethyl ether
Property Insights of Quercetagetin 3,4'-dimethyl ether
The XLogP value of 2.2996 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quercetagetin 3,4'-dimethyl ether. The TPSA of 129.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Quercetagetin 3,4'-dimethyl ether. Following Lipinski's Rule of Five, Quercetagetin 3,4'-dimethyl ether 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 Quercetagetin 3,4'-dimethyl ether?
The CAS number of Quercetagetin 3,4'-dimethyl ether is 59171-34-5.
What is the molecular formula of Quercetagetin 3,4'-dimethyl ether?
The molecular formula of Quercetagetin 3,4'-dimethyl ether is C17H14O8.
What is the molecular weight of Quercetagetin 3,4'-dimethyl ether?
The molecular weight of Quercetagetin 3,4'-dimethyl ether is 346.07 g/mol.
Where can I buy Quercetagetin 3,4'-dimethyl ether?
You can request a quote for Quercetagetin 3,4'-dimethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quercetagetin 3,4'-dimethyl ether?
Yes, KEHONG BIO provides custom synthesis services for Quercetagetin 3,4'-dimethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.