Rel-(2S,5R)-1,4-dithiane-2,5-diol
TL;DR: Rel-(2S,5R)-1,4-dithiane-2,5-diol (CAS 87602-27-5) is a chemical compound with molecular formula C4H8O2S2 and molecular weight 152.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R)-1,4-dithiane-2,5-diol
Also Known As: Dithian, (2S,5R)-1,4-dithiane-2,5-diol, Rel-(2S,5R)-1,4-dithiane-2,5-diol
| Molecular Formula | C4H8O2S2 |
|---|---|
| Molecular Weight | 152.00 g/mol |
| LogP | 0.1032 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 151.99657 |
| Heavy Atoms | 8 |
| Complexity | 60.43856 |
Chemical Identifiers
| CAS Number | 87602-27-5 |
|---|---|
| SMILES | C1[C@@H](SC[C@H](S1)O)O |
Product Overview
Rel-(2S,5R)-1,4-dithiane-2,5-diol (CAS 87602-27-5), with molecular formula C4H8O2S2 and molecular weight 152.00 g/mol. IUPAC: (2S,5R)-1,4-dithiane-2,5-diol.
Chemical Property Profile of Rel-(2S,5R)-1,4-dithiane-2,5-diol
Property Insights of Rel-(2S,5R)-1,4-dithiane-2,5-diol
The XLogP value of 0.1032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rel-(2S,5R)-1,4-dithiane-2,5-diol. With a topological polar surface area (TPSA) of 40.46 Ų, Rel-(2S,5R)-1,4-dithiane-2,5-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rel-(2S,5R)-1,4-dithiane-2,5-diol has 2 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 Rel-(2S,5R)-1,4-dithiane-2,5-diol?
The CAS number of Rel-(2S,5R)-1,4-dithiane-2,5-diol is 87602-27-5.
What is the molecular formula of Rel-(2S,5R)-1,4-dithiane-2,5-diol?
The molecular formula of Rel-(2S,5R)-1,4-dithiane-2,5-diol is C4H8O2S2.
What is the molecular weight of Rel-(2S,5R)-1,4-dithiane-2,5-diol?
The molecular weight of Rel-(2S,5R)-1,4-dithiane-2,5-diol is 152.00 g/mol.
Where can I buy Rel-(2S,5R)-1,4-dithiane-2,5-diol?
You can request a quote for Rel-(2S,5R)-1,4-dithiane-2,5-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rel-(2S,5R)-1,4-dithiane-2,5-diol?
Yes, KEHONG BIO provides custom synthesis services for Rel-(2S,5R)-1,4-dithiane-2,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.