Xanthevodine
TL;DR: Xanthevodine (CAS 477-78-1) is a chemical compound with molecular formula C16H13NO5 and molecular weight 299.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,11-dimethoxy-5H-[1,3]dioxolo[4,5-b]acridin-10-one
Also Known As: XANTHEVODINE, Cinnofuradione, Xanthevodin, KST-1B4588, 4,11-dimethoxy-5H-[1,3]dioxolo[4,5-b]acridin-10-one
| Molecular Formula | C16H13NO5 |
|---|---|
| Molecular Weight | 299.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.07938 |
| Heavy Atoms | 22 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 477-78-1 |
|---|---|
| SMILES | COC1=C2C(=C(C3=C1C(=O)C4=CC=CC=C4N3)OC)OCO2 |
| InChIKey | XKWQECWFQVTROA-UHFFFAOYSA-N |
Product Overview
Xanthevodine (CAS 477-78-1), with molecular formula C16H13NO5 and molecular weight 299.08 g/mol. IUPAC: 4,11-dimethoxy-5H-[1,3]dioxolo[4,5-b]acridin-10-one.
Chemical Property Profile of Xanthevodine
Property Insights of Xanthevodine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Xanthevodine. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Xanthevodine. Following Lipinski's Rule of Five, Xanthevodine 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 Xanthevodine?
The CAS number of Xanthevodine is 477-78-1.
What is the molecular formula of Xanthevodine?
The molecular formula of Xanthevodine is C16H13NO5.
What is the molecular weight of Xanthevodine?
The molecular weight of Xanthevodine is 299.08 g/mol.
Where can I buy Xanthevodine?
You can request a quote for Xanthevodine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthevodine?
Yes, KEHONG BIO provides custom synthesis services for Xanthevodine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.