Sophoradin
TL;DR: Sophoradin (CAS 23057-54-7) is a chemical compound with molecular formula C30H36O4 and molecular weight 460.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]prop-2-en-1-one
Also Known As: Sophoradin, Sophoradine, (E)-1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]prop-2-en-1-one, Chalcone, 2,4,4-trihydroxy-3,3,5-tris(3-methyl-2-butenyl)-, (2E)-1-(2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)phenyl)-3-(4-hydroxy-3,5-bis(3-methyl-2-buten-1-yl)phenyl)-2-propen-1-one
| Molecular Formula | C30H36O4 |
|---|---|
| Molecular Weight | 460.26 g/mol |
| LogP | 7.2256 |
| Topological Polar Surface Area | 77.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 460.26135 |
| Heavy Atoms | 34 |
| Complexity | 1123.5269 |
Chemical Identifiers
| CAS Number | 23057-54-7 |
|---|---|
| SMILES | CC(=CCC1=CC(=CC(=C1O)CC=C(C)C)/C=C/C(=O)C2=C(C(=C(C=C2)O)CC=C(C)C)O)C |
Product Overview
Sophoradin (CAS 23057-54-7), with molecular formula C30H36O4 and molecular weight 460.26 g/mol. IUPAC: (E)-1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]prop-2-en-1-one.
Chemical Property Profile of Sophoradin
Property Insights of Sophoradin
The XLogP value of 7.2256 indicates that Sophoradin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Sophoradin. Following Lipinski's Rule of Five, Sophoradin has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sophoradin?
The CAS number of Sophoradin is 23057-54-7.
What is the molecular formula of Sophoradin?
The molecular formula of Sophoradin is C30H36O4.
What is the molecular weight of Sophoradin?
The molecular weight of Sophoradin is 460.26 g/mol.
Where can I buy Sophoradin?
You can request a quote for Sophoradin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sophoradin?
Yes, KEHONG BIO provides custom synthesis services for Sophoradin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.