5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone
TL;DR: 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone (CAS 54087-33-1) is a chemical compound with molecular formula C19H16O8 and molecular weight 372.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-5-hydroxy-3,7,8-trimethoxychromen-4-one
Also Known As: 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone, NCI60_027975, 5-Hydroxy-3,8-trimethoxy-3',4'-methylenedioxyflavone, 2-(1,3-benzodioxol-5-yl)-5-hydroxy-3,7,8-trimethoxychromen-4-one, 5-Hydroxy-3,7,8-trimethoxy-3e^?4e^?methylenedioxyflavone
| Molecular Formula | C19H16O8 |
|---|---|
| Molecular Weight | 372.08 g/mol |
| LogP | 2.9201 |
| Topological Polar Surface Area | 96.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.0845 |
| Heavy Atoms | 27 |
| Complexity | 1099.2855 |
Chemical Identifiers
| CAS Number | 54087-33-1 |
|---|---|
| SMILES | COC1=C(C2=C(C(=C1)O)C(=O)C(=C(O2)C3=CC4=C(C=C3)OCO4)OC)OC |
Product Overview
5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone (CAS 54087-33-1), with molecular formula C19H16O8 and molecular weight 372.08 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-5-hydroxy-3,7,8-trimethoxychromen-4-one.
Chemical Property Profile of 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone
Property Insights of 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone
The XLogP value of 2.9201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone. The TPSA of 96.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone. Following Lipinski's Rule of Five, 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone has 1 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 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone?
The CAS number of 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone is 54087-33-1.
What is the molecular formula of 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone?
The molecular formula of 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone is C19H16O8.
What is the molecular weight of 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone?
The molecular weight of 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone is 372.08 g/mol.
Where can I buy 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone?
You can request a quote for 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxy-3,7,8-trimethoxy-3',4'-methylenedioxyflavone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.