Tagatosazine
TL;DR: Tagatosazine (CAS 13121-64-7) is a chemical compound with molecular formula C12H20N2O8 and molecular weight 320.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,3R)-1-[5-[(1R,2R,3R)-1,2,3,4-tetrahydroxybutyl]pyrazin-2-yl]butane-1,2,3,4-tetrol
Also Known As: Tagatosazine, Fructosazine, KST-1A1623, 2,5-Bis-(D-lyxotetrahydroxybutyl)pyrazine, 2,5-Bis-<5'-methylbenzoxazolyl(2')>-thiophene
| Molecular Formula | C12H20N2O8 |
|---|---|
| Molecular Weight | 320.12 g/mol |
| LogP | -5.7 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 320.12198 |
| Heavy Atoms | 22 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 13121-64-7 |
|---|---|
| SMILES | C1=C(N=CC(=N1)[C@H]([C@H]([C@@H](CO)O)O)O)[C@H]([C@H]([C@@H](CO)O)O)O |
| InChIKey | NPWQIVOYGNUVEB-JKCCIXDMSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tagatosazine (CAS 13121-64-7), with molecular formula C12H20N2O8 and molecular weight 320.12 g/mol. IUPAC: (1R,2R,3R)-1-[5-[(1R,2R,3R)-1,2,3,4-tetrahydroxybutyl]pyrazin-2-yl]butane-1,2,3,4-tetrol.
Chemical Property Profile of Tagatosazine
Property Insights of Tagatosazine
The XLogP value of -5.7 indicates that Tagatosazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 188.0 Ų indicates high polarity, suggesting Tagatosazine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tagatosazine has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tagatosazine?
The CAS number of Tagatosazine is 13121-64-7.
What is the molecular formula of Tagatosazine?
The molecular formula of Tagatosazine is C12H20N2O8.
What is the molecular weight of Tagatosazine?
The molecular weight of Tagatosazine is 320.12 g/mol.
Where can I buy Tagatosazine?
You can request a quote for Tagatosazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tagatosazine?
Yes, KEHONG BIO provides custom synthesis services for Tagatosazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.