4',5,7-Trimethoxyisoflavone
TL;DR: 4',5,7-Trimethoxyisoflavone (CAS 1162-82-9) is a chemical compound with molecular formula C18H16O5 and molecular weight 312.09976 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,7-dimethoxy-3-(4-methoxyphenyl)chromen-4-one
Also Known As: Genistein trimethyl ether, 4',5,7-Trimethoxyisoflavone, 5,7,4'-trimethoxyisoflavone, Genistein, permethyl, Tri-O-methylgenistein
Technical Specifications
| Molecular Formula | C18H16O5 |
| Molecular Weight | 312.09976 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.09976 Da |
| Heavy Atoms | 23 |
| Complexity | 452.0 |
| SMILES | COC1=CC=C(C=C1)C2=COC3=C(C2=O)C(=CC(=C3)OC)OC |
| InChIKey | PVVORTURQPBPEQ-UHFFFAOYSA-N |
Chemical Property Profile of 4',5,7-Trimethoxyisoflavone
Property Insights of 4',5,7-Trimethoxyisoflavone
The XLogP value of 3.1 indicates that 4',5,7-Trimethoxyisoflavone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 4',5,7-Trimethoxyisoflavone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4',5,7-Trimethoxyisoflavone has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4',5,7-Trimethoxyisoflavone?
The CAS number of 4',5,7-Trimethoxyisoflavone is 1162-82-9.
What is the molecular formula of 4',5,7-Trimethoxyisoflavone?
The molecular formula of 4',5,7-Trimethoxyisoflavone is C18H16O5.
What is the molecular weight of 4',5,7-Trimethoxyisoflavone?
The molecular weight of 4',5,7-Trimethoxyisoflavone is 312.09976 g/mol.
Where can I buy 4',5,7-Trimethoxyisoflavone?
You can request a quote for 4',5,7-Trimethoxyisoflavone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4',5,7-Trimethoxyisoflavone?
Yes, CoreyChem provides custom synthesis services for 4',5,7-Trimethoxyisoflavone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.