5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone
TL;DR: 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone (CAS 96887-20-6) is a chemical compound with molecular formula C20H20O10 and molecular weight 420.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-3,6,8-trimethoxychromen-4-one
Also Known As: NCI60_033081, 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone, 5,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone, 5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-3,6,8-trimethoxychromen-4-one, RefChem:101285
| Molecular Formula | C20H20O10 |
|---|---|
| Molecular Weight | 420.11 g/mol |
| LogP | 2.6198 |
| Topological Polar Surface Area | 137.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.10565 |
| Heavy Atoms | 30 |
| Complexity | 1179.1366 |
Chemical Identifiers
| CAS Number | 96887-20-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)O)C2=C(C(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)OC |
Product Overview
5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone (CAS 96887-20-6), with molecular formula C20H20O10 and molecular weight 420.11 g/mol. IUPAC: 5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-3,6,8-trimethoxychromen-4-one.
Chemical Property Profile of 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone
Property Insights of 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone
The XLogP value of 2.6198 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone. The TPSA of 137.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone. Following Lipinski's Rule of Five, 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone has 3 hydrogen bond donor(s) and 10 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 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone?
The CAS number of 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone is 96887-20-6.
What is the molecular formula of 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone?
The molecular formula of 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone is C20H20O10.
What is the molecular weight of 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone?
The molecular weight of 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone is 420.11 g/mol.
Where can I buy 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone?
You can request a quote for 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone?
Yes, KEHONG BIO provides custom synthesis services for 5,7,3'-Trihydroxy-3,6,8,4',5'-pentamethoxyflavone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.