4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione
TL;DR: 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione (CAS 128258-71-9) is a chemical compound with molecular formula C7H10O2S5 and molecular weight 285.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione
Also Known As: 4,5-bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione, 1,3-Dithiole-2-thione, 4,5-bis[(2-hydroxyethyl)thio]-, 2-Thioxo-4,5-bis(2-hydroxyethylthio)-1,3-dithiol, bis[(2-hydroxyethyl)sulfanyl]-2H-1,3-dithiole-2-thione, 4,5-Bis(2-hydroxyethylthio)-1,3-dithiol-2-thione
| Molecular Formula | C7H10O2S5 |
|---|---|
| Molecular Weight | 285.93 g/mol |
| LogP | 2.70789 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.92844 |
| Heavy Atoms | 14 |
| Complexity | 289.6252 |
Chemical Identifiers
| CAS Number | 128258-71-9 |
|---|---|
| SMILES | C(CSC1=C(SC(=S)S1)SCCO)O |
Product Overview
4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione (CAS 128258-71-9), with molecular formula C7H10O2S5 and molecular weight 285.93 g/mol. IUPAC: 4,5-bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione.
Chemical Property Profile of 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione
Property Insights of 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione
The XLogP value of 2.70789 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione. With a topological polar surface area (TPSA) of 40.46 Ų, 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione has 2 hydrogen bond donor(s) and 7 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 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione?
The CAS number of 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione is 128258-71-9.
What is the molecular formula of 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione?
The molecular formula of 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione is C7H10O2S5.
What is the molecular weight of 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione?
The molecular weight of 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione is 285.93 g/mol.
Where can I buy 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione?
You can request a quote for 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Bis(2-hydroxyethylsulfanyl)-1,3-dithiole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.