1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane
TL;DR: 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane (CAS 296-39-9) is a chemical compound with molecular formula C12H24O4S2 and molecular weight 296.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,10,13-tetraoxa-7,16-dithiacyclooctadecane
Also Known As: 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane, C1COCCSCCOCCOCCSCCO1, 1,10-Dithio-(18-crown-6), 1,7,13,16-tetraoxacyclooctadecane, 1,10-Dithia-4,7,13,16-tetraoxacyclooctadecane
| Molecular Formula | C12H24O4S2 |
|---|---|
| Molecular Weight | 296.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 296.1116 |
| Heavy Atoms | 18 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 296-39-9 |
|---|---|
| SMILES | C1COCCSCCOCCOCCSCCO1 |
| InChIKey | LIQFCELSAWJXJN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane (CAS 296-39-9), with molecular formula C12H24O4S2 and molecular weight 296.11 g/mol. IUPAC: 1,4,10,13-tetraoxa-7,16-dithiacyclooctadecane.
Chemical Property Profile of 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane
Property Insights of 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane. Following Lipinski's Rule of Five, 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane 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 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane?
The CAS number of 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane is 296-39-9.
What is the molecular formula of 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane?
The molecular formula of 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane is C12H24O4S2.
What is the molecular weight of 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane?
The molecular weight of 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane is 296.11 g/mol.
Where can I buy 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane?
You can request a quote for 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane?
Yes, KEHONG BIO provides custom synthesis services for 1,4,10,13-Tetraoxa-7,16-dithiacyclooctadecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.