3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone
TL;DR: 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone (CAS 105098-41-7) is a chemical compound with molecular formula C15H8Br2O6 and molecular weight 441.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]-4,6-dihydroxy-1-benzofuran-3-one
Also Known As: 3,5-Dbtha, 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone, 3',5'-Dibromo-2',4,4',6'-Tetrahydroxy Aurone, (2Z)-2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]-4,6-dihydroxy-1-benzofuran-3-one, (Z)-3',5'-dibromo-2',4,4',6'-tetrahydroxyaurone
| Molecular Formula | C15H8Br2O6 |
|---|---|
| Molecular Weight | 441.87 g/mol |
| LogP | 3.6502 |
| Topological Polar Surface Area | 107.22 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 441.86877 |
| Heavy Atoms | 23 |
| Complexity | 888.26636 |
Chemical Identifiers
| CAS Number | 105098-41-7 |
|---|---|
| SMILES | C1=C(C=C2C(=C1O)C(=O)/C(=C/C3=CC(=C(C(=C3O)Br)O)Br)/O2)O |
Product Overview
3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone (CAS 105098-41-7), with molecular formula C15H8Br2O6 and molecular weight 441.87 g/mol. IUPAC: (2Z)-2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]-4,6-dihydroxy-1-benzofuran-3-one.
Chemical Property Profile of 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone
Property Insights of 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone
The XLogP value of 3.6502 indicates that 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone. Following Lipinski's Rule of Five, 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone has 4 hydrogen bond donor(s) and 6 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',5'-Dibromo-2',4,4',6-tetrahydroxyaurone?
The CAS number of 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone is 105098-41-7.
What is the molecular formula of 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone?
The molecular formula of 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone is C15H8Br2O6.
What is the molecular weight of 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone?
The molecular weight of 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone is 441.87 g/mol.
Where can I buy 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone?
You can request a quote for 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone?
Yes, KEHONG BIO provides custom synthesis services for 3',5'-Dibromo-2',4,4',6-tetrahydroxyaurone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.