Prunetin
TL;DR: Prunetin (CAS 552-59-0) is a chemical compound with molecular formula C16H12O5 and molecular weight 284.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-3-(4-hydroxyphenyl)-7-methoxychromen-4-one
Also Known As: Prunetin, Prunusetin, Padmakastein, pruneitin, 5,4'-dihydroxy-7-methoxyisoflavone
| Molecular Formula | C16H12O5 |
|---|---|
| Molecular Weight | 284.07 g/mol |
| LogP | 2.8798 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.06848 |
| Heavy Atoms | 21 |
| Complexity | 862.21 |
Chemical Identifiers
| CAS Number | 552-59-0 |
|---|---|
| SMILES | COC1=CC(=C2C(=C1)OC=C(C2=O)C3=CC=C(C=C3)O)O |
Product Overview
Prunetin (CAS 552-59-0), with molecular formula C16H12O5 and molecular weight 284.07 g/mol. IUPAC: 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxychromen-4-one.
Chemical Property Profile of Prunetin
Property Insights of Prunetin
The XLogP value of 2.8798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Prunetin. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Prunetin. Following Lipinski's Rule of Five, Prunetin has 2 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 Prunetin?
The CAS number of Prunetin is 552-59-0.
What is the molecular formula of Prunetin?
The molecular formula of Prunetin is C16H12O5.
What is the molecular weight of Prunetin?
The molecular weight of Prunetin is 284.07 g/mol.
Where can I buy Prunetin?
You can request a quote for Prunetin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prunetin?
Yes, KEHONG BIO provides custom synthesis services for Prunetin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.