甘草查尔酮A
TL;DR: 甘草查尔酮A (CAS 58749-22-7) is a chemical compound with molecular formula C21H22O4 and molecular weight 338.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甘草查尔酮A
3-[4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one
Also Known As: licochalcone a, LicochalconeA, Licochalcone-A, Licochalcone-A, Synthetic, 5-(1,1-dimethylallyl)-4,4'-dihydroxy-2-methoxychalcone
| Molecular Formula | C21H22O4 |
|---|---|
| Molecular Weight | 338.15 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.1518 |
| Heavy Atoms | 25 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 58749-22-7 |
|---|---|
| SMILES | CC(C)(C=C)C1=C(C=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)O)OC)O |
| InChIKey | KAZSKMJFUPEHHW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甘草查尔酮A (CAS 58749-22-7), with molecular formula C21H22O4 and molecular weight 338.15 g/mol. IUPAC: 3-[4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one.
Chemical Property Profile of 甘草查尔酮A
Property Insights of 甘草查尔酮A
The XLogP value of 4.9 indicates that 甘草查尔酮A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 甘草查尔酮A. Following Lipinski's Rule of Five, 甘草查尔酮A has 2 hydrogen bond donor(s) and 4 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 甘草查尔酮A?
The CAS number of 甘草查尔酮A is 58749-22-7.
What is the molecular formula of 甘草查尔酮A?
The molecular formula of 甘草查尔酮A is C21H22O4.
What is the molecular weight of 甘草查尔酮A?
The molecular weight of 甘草查尔酮A is 338.15 g/mol.
Where can I buy 甘草查尔酮A?
You can request a quote for 甘草查尔酮A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甘草查尔酮A?
Yes, KEHONG BIO provides custom synthesis services for 甘草查尔酮A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.