1,3,4,6-四硫杂戊搭烯-2,5-二酮
TL;DR: 1,3,4,6-四硫杂戊搭烯-2,5-二酮 (CAS 64394-45-2) is a chemical compound with molecular formula C4H2O2S4 and molecular weight 209.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,4,6-四硫杂戊搭烯-2,5-二酮
3a,6a-dihydro-[1,3]dithiolo[4,5-d][1,3]dithiole-2,5-dione
Also Known As: Thiapendione, 1,3,4,6-Tetrathiapentalene-2,5-dione, [1,3]Dithiolo[4,5-d]-1,3-dithiole-2,5-dione, [1,3]Dithiolo[4,5-d][1,3]dithiole-2,5-dione, 2,4,6,8-tetrathiabicyclo[3.3.0]octane-3,7-dione
| Molecular Formula | C4H2O2S4 |
|---|---|
| Molecular Weight | 209.89 g/mol |
| LogP | 2.8386 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.89377 |
| Heavy Atoms | 10 |
| Complexity | 165.43427 |
Chemical Identifiers
| CAS Number | 64394-45-2 |
|---|---|
| SMILES | C12C(SC(=O)S1)SC(=O)S2 |
Product Overview
1,3,4,6-四硫杂戊搭烯-2,5-二酮 (CAS 64394-45-2), with molecular formula C4H2O2S4 and molecular weight 209.89 g/mol. IUPAC: 3a,6a-dihydro-[1,3]dithiolo[4,5-d][1,3]dithiole-2,5-dione.
Chemical Property Profile of 1,3,4,6-四硫杂戊搭烯-2,5-二酮
Property Insights of 1,3,4,6-四硫杂戊搭烯-2,5-二酮
The XLogP value of 2.8386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4,6-四硫杂戊搭烯-2,5-二酮. With a topological polar surface area (TPSA) of 34.14 Ų, 1,3,4,6-四硫杂戊搭烯-2,5-二酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4,6-四硫杂戊搭烯-2,5-二酮 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 1,3,4,6-四硫杂戊搭烯-2,5-二酮?
The CAS number of 1,3,4,6-四硫杂戊搭烯-2,5-二酮 is 64394-45-2.
What is the molecular formula of 1,3,4,6-四硫杂戊搭烯-2,5-二酮?
The molecular formula of 1,3,4,6-四硫杂戊搭烯-2,5-二酮 is C4H2O2S4.
What is the molecular weight of 1,3,4,6-四硫杂戊搭烯-2,5-二酮?
The molecular weight of 1,3,4,6-四硫杂戊搭烯-2,5-二酮 is 209.89 g/mol.
Where can I buy 1,3,4,6-四硫杂戊搭烯-2,5-二酮?
You can request a quote for 1,3,4,6-四硫杂戊搭烯-2,5-二酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4,6-四硫杂戊搭烯-2,5-二酮?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4,6-四硫杂戊搭烯-2,5-二酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.