2-Thiokojibiose
TL;DR: 2-Thiokojibiose (CAS 19533-92-7) is a chemical compound with molecular formula C12H22O10S and molecular weight 358.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyloxane-2,4,5-triol
Also Known As: 2-Thiokojibiose, 2-Thiosophorose, 2-S-Hexopyranosyl-2-thiohexopyranose, 2-s-, A-d-glucopyranosyl-2-thio-
| Molecular Formula | C12H22O10S |
|---|---|
| Molecular Weight | 358.09 g/mol |
| LogP | -3.4 |
| Topological Polar Surface Area | 206.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.09335 |
| Heavy Atoms | 23 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 19533-92-7 |
|---|---|
| SMILES | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)S[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O |
| InChIKey | LZOBVHNAVZABHO-LFWCVFAXSA-N |
Product Overview
2-Thiokojibiose (CAS 19533-92-7), with molecular formula C12H22O10S and molecular weight 358.09 g/mol. IUPAC: (2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyloxane-2,4,5-triol.
Chemical Property Profile of 2-Thiokojibiose
Property Insights of 2-Thiokojibiose
The XLogP value of -3.4 indicates that 2-Thiokojibiose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 206.0 Ų indicates high polarity, suggesting 2-Thiokojibiose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Thiokojibiose has 8 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Thiokojibiose?
The CAS number of 2-Thiokojibiose is 19533-92-7.
What is the molecular formula of 2-Thiokojibiose?
The molecular formula of 2-Thiokojibiose is C12H22O10S.
What is the molecular weight of 2-Thiokojibiose?
The molecular weight of 2-Thiokojibiose is 358.09 g/mol.
Where can I buy 2-Thiokojibiose?
You can request a quote for 2-Thiokojibiose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thiokojibiose?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiokojibiose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.