5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol
TL;DR: 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol (CAS 64780-60-5) is a chemical compound with molecular formula C20H26O5S2 and molecular weight 410.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4S,5R)-6,6-bis(benzylsulfanyl)hexane-1,2,3,4,5-pentol
Also Known As: D-Galactose dibenzyldithioacetal, J2.051.970C, 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol, 6,6-bis(benzylsulfanyl)hexane-1,2,3,4,5-pentol, (2R,3S,4S,5R)-6,6-bis(benzylsulfanyl)hexane-1,2,3,4,5-pentol
| Molecular Formula | C20H26O5S2 |
|---|---|
| Molecular Weight | 410.12 g/mol |
| LogP | 1.6152 |
| Topological Polar Surface Area | 101.15 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 410.12216 |
| Heavy Atoms | 27 |
| Complexity | 599.835 |
Chemical Identifiers
| CAS Number | 64780-60-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC([C@@H]([C@H]([C@H]([C@@H](CO)O)O)O)O)SCC2=CC=CC=C2 |
Product Overview
5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol (CAS 64780-60-5), with molecular formula C20H26O5S2 and molecular weight 410.12 g/mol. IUPAC: (2R,3S,4S,5R)-6,6-bis(benzylsulfanyl)hexane-1,2,3,4,5-pentol.
Chemical Property Profile of 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol
Property Insights of 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol
The XLogP value of 1.6152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol. The TPSA of 101.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol. Following Lipinski's Rule of Five, 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol has 5 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 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol?
The CAS number of 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol is 64780-60-5.
What is the molecular formula of 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol?
The molecular formula of 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol is C20H26O5S2.
What is the molecular weight of 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol?
The molecular weight of 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol is 410.12 g/mol.
Where can I buy 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol?
You can request a quote for 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Bis(benzylthio)pentane-1,2,3,4-tetraol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.