5,5'-Dimethoxysecoisolariciresinol
TL;DR: 5,5'-Dimethoxysecoisolariciresinol (CAS 1002106-91-3) is a chemical compound with molecular formula C22H30O8 and molecular weight 422.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R)-2,3-bis[(4-hydroxy-3,5-dimethoxyphenyl)methyl]butane-1,4-diol
Also Known As: 5,5'-Dimethoxysecoisolariciresinol, Dimethoxysecoisolariciresinol, 55-Dimethoxysecoisolariciresinol, (-)-8,8'-Bisdihydrosiringenin, HY-N8581
| Molecular Formula | C22H30O8 |
|---|---|
| Molecular Weight | 422.19 g/mol |
| LogP | 2.1344 |
| Topological Polar Surface Area | 117.84 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 422.19406 |
| Heavy Atoms | 30 |
| Complexity | 716.3726 |
Chemical Identifiers
| CAS Number | 1002106-91-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)C[C@@H](CO)[C@@H](CC2=CC(=C(C(=C2)OC)O)OC)CO |
Product Overview
5,5'-Dimethoxysecoisolariciresinol (CAS 1002106-91-3), with molecular formula C22H30O8 and molecular weight 422.19 g/mol. IUPAC: (2R,3R)-2,3-bis[(4-hydroxy-3,5-dimethoxyphenyl)methyl]butane-1,4-diol.
Chemical Property Profile of 5,5'-Dimethoxysecoisolariciresinol
Property Insights of 5,5'-Dimethoxysecoisolariciresinol
The XLogP value of 2.1344 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5'-Dimethoxysecoisolariciresinol. The TPSA of 117.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5'-Dimethoxysecoisolariciresinol. Following Lipinski's Rule of Five, 5,5'-Dimethoxysecoisolariciresinol has 4 hydrogen bond donor(s) and 8 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 5,5'-Dimethoxysecoisolariciresinol?
The CAS number of 5,5'-Dimethoxysecoisolariciresinol is 1002106-91-3.
What is the molecular formula of 5,5'-Dimethoxysecoisolariciresinol?
The molecular formula of 5,5'-Dimethoxysecoisolariciresinol is C22H30O8.
What is the molecular weight of 5,5'-Dimethoxysecoisolariciresinol?
The molecular weight of 5,5'-Dimethoxysecoisolariciresinol is 422.19 g/mol.
Where can I buy 5,5'-Dimethoxysecoisolariciresinol?
You can request a quote for 5,5'-Dimethoxysecoisolariciresinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5'-Dimethoxysecoisolariciresinol?
Yes, KEHONG BIO provides custom synthesis services for 5,5'-Dimethoxysecoisolariciresinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.