Vermistatin
TL;DR: Vermistatin (CAS 131602-06-7) 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.
(3R)-4,6-dimethoxy-3-[4-oxo-6-[(E)-prop-1-enyl]pyran-3-yl]-3H-2-benzofuran-1-one
Also Known As: Vermistatin, Fijiensin, (-)-Fijiensin, 5-(4,6-Dimethoxyphthalidyl)-2-propenyl-4H-pyran-4-one, (3R)-4,6-dimethoxy-3-[4-oxo-6-[(E)-prop-1-enyl]pyran-3-yl]-3H-2-benzofuran-1-one
| Molecular Formula | C18H16O6 |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 2.9499 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.0947 |
| Heavy Atoms | 24 |
| Complexity | 877.5631 |
Chemical Identifiers
| CAS Number | 131602-06-7 |
|---|---|
| SMILES | C/C=C/C1=CC(=O)C(=CO1)[C@H]2C3=C(C=C(C=C3OC)OC)C(=O)O2 |
Product Overview
Vermistatin (CAS 131602-06-7), with molecular formula C18H16O6 and molecular weight 328.09 g/mol. IUPAC: (3R)-4,6-dimethoxy-3-[4-oxo-6-[(E)-prop-1-enyl]pyran-3-yl]-3H-2-benzofuran-1-one.
Chemical Property Profile of Vermistatin
Property Insights of Vermistatin
The XLogP value of 2.9499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vermistatin. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Vermistatin. Following Lipinski's Rule of Five, Vermistatin 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 Vermistatin?
The CAS number of Vermistatin is 131602-06-7.
What is the molecular formula of Vermistatin?
The molecular formula of Vermistatin is C18H16O6.
What is the molecular weight of Vermistatin?
The molecular weight of Vermistatin is 328.09 g/mol.
Where can I buy Vermistatin?
You can request a quote for Vermistatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vermistatin?
Yes, KEHONG BIO provides custom synthesis services for Vermistatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.