三裂鼠尾草素
TL;DR: 三裂鼠尾草素 (CAS 21879-13-0) is a chemical compound with molecular formula C18H16O6 and molecular weight 328.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三裂鼠尾草素
5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)chromen-4-one
Also Known As: Salvigenin, psathyrotin, Salvesigenine, 7-O-methylpectolinarigenin, 5-Hydroxy-6,7,4'-trimethoxyflavone
| Molecular Formula | C18H16O6 |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.0947 |
| Heavy Atoms | 24 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 21879-13-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O |
| InChIKey | QCDYOIZVELGOLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三裂鼠尾草素 (CAS 21879-13-0), with molecular formula C18H16O6 and molecular weight 328.09 g/mol. IUPAC: 5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)chromen-4-one.
Chemical Property Profile of 三裂鼠尾草素
Property Insights of 三裂鼠尾草素
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三裂鼠尾草素. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 三裂鼠尾草素. Following Lipinski's Rule of Five, 三裂鼠尾草素 has 1 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 三裂鼠尾草素?
The CAS number of 三裂鼠尾草素 is 21879-13-0.
What is the molecular formula of 三裂鼠尾草素?
The molecular formula of 三裂鼠尾草素 is C18H16O6.
What is the molecular weight of 三裂鼠尾草素?
The molecular weight of 三裂鼠尾草素 is 328.09 g/mol.
Where can I buy 三裂鼠尾草素?
You can request a quote for 三裂鼠尾草素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三裂鼠尾草素?
Yes, KEHONG BIO provides custom synthesis services for 三裂鼠尾草素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.