![1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione structure](/static/products/1025/102567-30-6.webp)
1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione
TL;DR: 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione (CAS 102567-30-6) is a chemical compound with molecular formula C5H4S6 and molecular weight 255.86372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1,3]dithiolo[4,5-f][1,3,5]trithiepine-2-thione
Also Known As: 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione, [1,3]dithiolo[4,5-f][1,3,5]trithiepine-2-thione, 1,3-dithiolo<4,5-f><1,3,5>trithiepin-2-thione, 2,4,6,8,10-pentathiabicyclo[5.3.0]dec-11-ene-9-thione, 5H,7H-1,3-dithioleno[4,5-f]1,3,5-trithiepin-2-thione
Technical Specifications
| Molecular Formula | C5H4S6 |
| Molecular Weight | 255.86372 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 159.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 255.86372 Da |
| Heavy Atoms | 11 |
| Complexity | 199.0 |
| SMILES | C1SCSC2=C(S1)SC(=S)S2 |
| InChIKey | FNJMUDIOIVOUGJ-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione
Property Insights of 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione
The XLogP value of 4.0 indicates that 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 159.0 Ų indicates high polarity, suggesting 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione 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
What is the CAS number of 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione?
The CAS number of 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione is 102567-30-6.
What is the molecular formula of 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione?
The molecular formula of 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione is C5H4S6.
What is the molecular weight of 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione?
The molecular weight of 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione is 255.86372 g/mol.
Where can I buy 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione?
You can request a quote for 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione?
Yes, CoreyChem provides custom synthesis services for 1,3-Dithiolo[4,5-f][1,3,5]trithiepin-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.