3',4',5,7-Tetrahydroxy-8-methoxyisoflavone
TL;DR: 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone (CAS 58262-89-8) is a chemical compound with molecular formula C16H12O7 and molecular weight 316.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-methoxychromen-4-one
Also Known As: 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone, 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-methoxychromen-4-one, 5-18-05-00569 (Beilstein Handbook Reference), 5,7-Dihydroxy-3-(3,4-dihydroxyphenyl)-8-methoxy-4H-1-benzopyran-4-one, 3-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-8-methoxy-4H-1-benzopyran-4-one
| Molecular Formula | C16H12O7 |
|---|---|
| Molecular Weight | 316.06 g/mol |
| LogP | 2.291 |
| Topological Polar Surface Area | 120.36 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.0583 |
| Heavy Atoms | 23 |
| Complexity | 972.3052 |
Chemical Identifiers
| CAS Number | 58262-89-8 |
|---|---|
| SMILES | COC1=C(C=C(C2=C1OC=C(C2=O)C3=CC(=C(C=C3)O)O)O)O |
Product Overview
3',4',5,7-Tetrahydroxy-8-methoxyisoflavone (CAS 58262-89-8), with molecular formula C16H12O7 and molecular weight 316.06 g/mol. IUPAC: 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-methoxychromen-4-one.
Chemical Property Profile of 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone
Property Insights of 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone
The XLogP value of 2.291 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone. The TPSA of 120.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone. Following Lipinski's Rule of Five, 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone has 4 hydrogen bond donor(s) and 7 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 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone?
The CAS number of 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone is 58262-89-8.
What is the molecular formula of 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone?
The molecular formula of 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone is C16H12O7.
What is the molecular weight of 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone?
The molecular weight of 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone is 316.06 g/mol.
Where can I buy 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone?
You can request a quote for 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone?
Yes, KEHONG BIO provides custom synthesis services for 3',4',5,7-Tetrahydroxy-8-methoxyisoflavone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.