1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone
TL;DR: 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone (CAS 21620-30-4) is a chemical compound with molecular formula C10H12O4S4 and molecular weight 323.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,8,11-tetrathiacyclotetradecane-5,7,12,14-tetrone
Also Known As: 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone, 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone #, Malonic acid, 1,3-dithio-, bimol. cyclic S,S-ethylene ester, RefChem:219952
| Molecular Formula | C10H12O4S4 |
|---|---|
| Molecular Weight | 323.96 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 169.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 323.96185 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 21620-30-4 |
|---|---|
| SMILES | C1CSC(=O)CC(=O)SCCSC(=O)CC(=O)S1 |
| InChIKey | TURBTOJBTBVETG-UHFFFAOYSA-N |
Product Overview
1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone (CAS 21620-30-4), with molecular formula C10H12O4S4 and molecular weight 323.96 g/mol. IUPAC: 1,4,8,11-tetrathiacyclotetradecane-5,7,12,14-tetrone.
Chemical Property Profile of 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone
Property Insights of 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone. The TPSA of 169.0 Ų indicates high polarity, suggesting 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone has 0 hydrogen bond donor(s) and 8 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 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone?
The CAS number of 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone is 21620-30-4.
What is the molecular formula of 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone?
The molecular formula of 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone is C10H12O4S4.
What is the molecular weight of 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone?
The molecular weight of 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone is 323.96 g/mol.
Where can I buy 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone?
You can request a quote for 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone?
Yes, KEHONG BIO provides custom synthesis services for 1,4,8,11-Tetrathiacyclotetradecane-5,7,12,14-tetrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.