3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione
TL;DR: 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione (CAS 79295-21-9) is a chemical compound with molecular formula C10H20O3S2 and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hexylsulfanyl-1,1-dioxothiolan-3-ol
Also Known As: 3-Oxy-4-(1-hexylthio)-sulfolan, 3-Oxy-4-(1-hexylthio)-sulfolane, 4-hexylsulfanyl-1,1-dioxothiolan-3-ol, Tetrahydro-4-(hexylthio)-3-thiophenol 1,1-dioxide, 3-Thiophenol, tetrahydro-4-(hexylthio)-, 1,1-dioxide
| Molecular Formula | C10H20O3S2 |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 1.4578 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 252.08539 |
| Heavy Atoms | 15 |
| Complexity | 274.3921 |
Chemical Identifiers
| CAS Number | 79295-21-9 |
|---|---|
| SMILES | CCCCCCSC1CS(=O)(=O)CC1O |
Product Overview
3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione (CAS 79295-21-9), with molecular formula C10H20O3S2 and molecular weight 252.09 g/mol. IUPAC: 4-hexylsulfanyl-1,1-dioxothiolan-3-ol.
Chemical Property Profile of 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione
Property Insights of 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione
The XLogP value of 1.4578 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione. With a topological polar surface area (TPSA) of 54.37 Ų, 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione has 1 hydrogen bond donor(s) and 4 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 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione?
The CAS number of 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione is 79295-21-9.
What is the molecular formula of 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione?
The molecular formula of 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione is C10H20O3S2.
What is the molecular weight of 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione?
The molecular weight of 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione is 252.09 g/mol.
Where can I buy 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione?
You can request a quote for 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(Hexylsulfanyl)-4-hydroxy-1lambda~6~-thiolane-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.