Sabandinol
TL;DR: Sabandinol (CAS 52146-70-0) is a chemical compound with molecular formula C15H16O7 and molecular weight 308.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(2,3-dihydroxy-3-methylbutoxy)-[1,3]dioxolo[4,5-g]chromen-6-one
Also Known As: Sabandinol, NCI60_017218, 5-[oxy]-8h-1,3-dioxolo[4,5-h][1]benzopyran-8-one, 9-(2,3-dihydroxy-3-methylbutoxy)-[1,3]dioxolo[4,5-g]chromen-6-one, 5-(2,3-Dihydroxy-3-methylbutoxy)-6,7-(methylenedioxy)coumarin
| Molecular Formula | C15H16O7 |
|---|---|
| Molecular Weight | 308.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.0896 |
| Heavy Atoms | 22 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 52146-70-0 |
|---|---|
| SMILES | CC(C)(C(COC1=C2C=CC(=O)OC2=CC3=C1OCO3)O)O |
| InChIKey | RDPGEFVUMRTSBB-UHFFFAOYSA-N |
Product Overview
Sabandinol (CAS 52146-70-0), with molecular formula C15H16O7 and molecular weight 308.09 g/mol. IUPAC: 9-(2,3-dihydroxy-3-methylbutoxy)-[1,3]dioxolo[4,5-g]chromen-6-one.
Chemical Property Profile of Sabandinol
Property Insights of Sabandinol
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sabandinol. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Sabandinol. Following Lipinski's Rule of Five, Sabandinol has 2 hydrogen bond donor(s) and 7 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 Sabandinol?
The CAS number of Sabandinol is 52146-70-0.
What is the molecular formula of Sabandinol?
The molecular formula of Sabandinol is C15H16O7.
What is the molecular weight of Sabandinol?
The molecular weight of Sabandinol is 308.09 g/mol.
Where can I buy Sabandinol?
You can request a quote for Sabandinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sabandinol?
Yes, KEHONG BIO provides custom synthesis services for Sabandinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.