(4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate
TL;DR: (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate (CAS 63177-62-8) is a chemical compound with molecular formula C8H12S6 and molecular weight 299.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate
Also Known As: trans-2,4-bis(thioacetylthio)-1,3-dithietane, (4-ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate, 2,4-Dimethyl-1,3-dithietane-2,4-diyl diethane(dithioate), (4-ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) eth, Ethane(dithioic) acid, 2,4-dimethyl-1,3-dithietane-2,4-diyl ester, trans-
| Molecular Formula | C8H12S6 |
|---|---|
| Molecular Weight | 299.93 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 165.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.92633 |
| Heavy Atoms | 14 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 63177-62-8 |
|---|---|
| SMILES | CC(=S)SC1(SC(S1)(C)SC(=S)C)C |
| InChIKey | WMFWCFPNMFSFSO-UHFFFAOYSA-N |
Product Overview
(4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate (CAS 63177-62-8), with molecular formula C8H12S6 and molecular weight 299.93 g/mol. IUPAC: (4-ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate.
Chemical Property Profile of (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate
Property Insights of (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate
The XLogP value of 4.2 indicates that (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 165.0 Ų indicates high polarity, suggesting (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate 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 (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate?
The CAS number of (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate is 63177-62-8.
What is the molecular formula of (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate?
The molecular formula of (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate is C8H12S6.
What is the molecular weight of (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate?
The molecular weight of (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate is 299.93 g/mol.
Where can I buy (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate?
You can request a quote for (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate?
Yes, KEHONG BIO provides custom synthesis services for (4-Ethanethioylsulfanyl-2,4-dimethyl-1,3-dithietan-2-yl) ethanedithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.