Sophorol
TL;DR: Sophorol (CAS 524-08-3) is a chemical compound with molecular formula C16H12O6 and molecular weight 300.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-2,3-dihydrochromen-4-one
Also Known As: Sophorol, 2',7-Dihydroxy-4',5'-(methylenedioxy)isoflavanone, 7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-2,3-dihydrochromen-4-one, (+)-2,3-Dihydro-7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-4H-1-benzopyran-4-one, 4H-1-Benzopyran-4-one, 2,3-dihydro-7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-, (+)-
| Molecular Formula | C16H12O6 |
|---|---|
| Molecular Weight | 300.06 g/mol |
| LogP | 2.1854 |
| Topological Polar Surface Area | 85.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 300.0634 |
| Heavy Atoms | 22 |
| Complexity | 782.44574 |
Chemical Identifiers
| CAS Number | 524-08-3 |
|---|---|
| SMILES | C1C(C(=O)C2=C(O1)C=C(C=C2)O)C3=CC4=C(C=C3O)OCO4 |
Product Overview
Sophorol (CAS 524-08-3), with molecular formula C16H12O6 and molecular weight 300.06 g/mol. IUPAC: 7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-2,3-dihydrochromen-4-one.
Chemical Property Profile of Sophorol
Property Insights of Sophorol
The XLogP value of 2.1854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sophorol. The TPSA of 85.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Sophorol. Following Lipinski's Rule of Five, Sophorol has 2 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 Sophorol?
The CAS number of Sophorol is 524-08-3.
What is the molecular formula of Sophorol?
The molecular formula of Sophorol is C16H12O6.
What is the molecular weight of Sophorol?
The molecular weight of Sophorol is 300.06 g/mol.
Where can I buy Sophorol?
You can request a quote for Sophorol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sophorol?
Yes, KEHONG BIO provides custom synthesis services for Sophorol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.