![5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- structure](/static/products/1299/129993-53-9.webp)
5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-
TL;DR: 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- (CAS 129993-53-9) is a chemical compound with molecular formula C6H4OS5 and molecular weight 251.88657 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-sulfanylidene-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-one
Also Known As: BAS 00733176, 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-, AB01329881-02, 2-Thioxo-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-one, 2-sulfanylidene-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-one
Technical Specifications
| Molecular Formula | C6H4OS5 |
| Molecular Weight | 251.88657 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 150.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.88657 Da |
| Heavy Atoms | 12 |
| Complexity | 258.0 |
| SMILES | C1C(=O)CSC2=C(S1)SC(=S)S2 |
| InChIKey | MFRWFNJNFMWPJJ-UHFFFAOYSA-N |
Chemical Property Profile of 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-
Property Insights of 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-
The XLogP value of 3.1 indicates that 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- 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 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-?
The CAS number of 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- is 129993-53-9.
What is the molecular formula of 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-?
The molecular formula of 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- is C6H4OS5.
What is the molecular weight of 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-?
The molecular weight of 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- is 251.88657 g/mol.
Where can I buy 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-?
You can request a quote for 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo-?
Yes, CoreyChem provides custom synthesis services for 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-6(7H)-one, 2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.