Isosativanone
TL;DR: Isosativanone (CAS 82829-55-8) is a chemical compound with molecular formula C17H16O5 and molecular weight 300.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxy-4-methoxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one
Also Known As: Isosativanone, 2'-Hydroxy-7,4'-dimethoxyisoflavanone, 7,4 -Dimethoxy-2 -hydroxyisoflavanone, 4H-1-Benzopyran-4-one, 2,3-dihydro-3-(2-hydroxy-4-methoxyphenyl)-7-methoxy-, 3-(2-Hydroxy-4-methoxyphenyl)-7-methoxy-2,3-dihydro-4H-1-benzopyran-4-one
| Molecular Formula | C17H16O5 |
|---|---|
| Molecular Weight | 300.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.09976 |
| Heavy Atoms | 22 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 82829-55-8 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2COC3=C(C2=O)C=CC(=C3)OC)O |
| InChIKey | DGASCIUHCLOTGU-UHFFFAOYSA-N |
Product Overview
Isosativanone (CAS 82829-55-8), with molecular formula C17H16O5 and molecular weight 300.10 g/mol. IUPAC: 3-(2-hydroxy-4-methoxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one.
Chemical Property Profile of Isosativanone
Property Insights of Isosativanone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isosativanone. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isosativanone. Following Lipinski's Rule of Five, Isosativanone has 1 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 Isosativanone?
The CAS number of Isosativanone is 82829-55-8.
What is the molecular formula of Isosativanone?
The molecular formula of Isosativanone is C17H16O5.
What is the molecular weight of Isosativanone?
The molecular weight of Isosativanone is 300.10 g/mol.
Where can I buy Isosativanone?
You can request a quote for Isosativanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isosativanone?
Yes, KEHONG BIO provides custom synthesis services for Isosativanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.