Betagarin
TL;DR: Betagarin (CAS 60132-69-6) 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.
(6S)-9-methoxy-6-(2-methoxyphenyl)-6,7-dihydro-[1,3]dioxolo[4,5-g]chromen-8-one
Also Known As: Betagarin, 5,2'-Dimethoxy-6,7-methylenedioxyflavanone, 2',5-Dimethoxy-6,7-methylenedioxyflavanone, (S)-, 8H-1,3-Dioxolo(4,5-g)(1)benzopyran-8-one, 6,7-dihydro-9-methoxy-6-(2-methoxyphenyl)-, (6S)-, (6S)-9-methoxy-6-(2-methoxyphenyl)-6,7-dihydro-[1,3]dioxolo[4,5-g]chromen-8-one
| Molecular Formula | C18H16O6 |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.0947 |
| Heavy Atoms | 24 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 60132-69-6 |
|---|---|
| SMILES | COC1=CC=CC=C1[C@@H]2CC(=O)C3=C(C4=C(C=C3O2)OCO4)OC |
| InChIKey | IHPVFYLOGNNZLA-ZDUSSCGKSA-N |
Product Overview
Betagarin (CAS 60132-69-6), with molecular formula C18H16O6 and molecular weight 328.09 g/mol. IUPAC: (6S)-9-methoxy-6-(2-methoxyphenyl)-6,7-dihydro-[1,3]dioxolo[4,5-g]chromen-8-one.
Chemical Property Profile of Betagarin
Property Insights of Betagarin
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Betagarin. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Betagarin. Following Lipinski's Rule of Five, Betagarin has 0 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 Betagarin?
The CAS number of Betagarin is 60132-69-6.
What is the molecular formula of Betagarin?
The molecular formula of Betagarin is C18H16O6.
What is the molecular weight of Betagarin?
The molecular weight of Betagarin is 328.09 g/mol.
Where can I buy Betagarin?
You can request a quote for Betagarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betagarin?
Yes, KEHONG BIO provides custom synthesis services for Betagarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.