1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside
TL;DR: 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside (CAS 6988-61-0) is a chemical compound with molecular formula C18H25N3O9 and molecular weight 427.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-6-[1,3,4-trihydroxy-1-(2-phenyltriazol-4-yl)butan-2-yl]oxyoxane-3,4,5-triol
Also Known As: A2998/0126316, 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside, 2-(hydroxymethyl)-6-[1,3,4-trihydroxy-1-(2-phenyltriazol-4-y, 2-(hydroxymethyl)-6-[1,3,4-trihydroxy-1-(2-phenyltriazol-4-yl)butan-2-yl]oxyoxane-3,4,5-triol
| Molecular Formula | C18H25N3O9 |
|---|---|
| Molecular Weight | 427.16 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 427.1591 |
| Heavy Atoms | 30 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 6988-61-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2N=CC(=N2)C(C(C(CO)O)OC3C(C(C(C(O3)CO)O)O)O)O |
| InChIKey | DEUYLKANTRPZII-UHFFFAOYSA-N |
Product Overview
1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside (CAS 6988-61-0), with molecular formula C18H25N3O9 and molecular weight 427.16 g/mol. IUPAC: 2-(hydroxymethyl)-6-[1,3,4-trihydroxy-1-(2-phenyltriazol-4-yl)butan-2-yl]oxyoxane-3,4,5-triol.
Chemical Property Profile of 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside
Property Insights of 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside
The XLogP value of -2.4 indicates that 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 191.0 Ų indicates high polarity, suggesting 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside has 7 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 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside?
The CAS number of 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside is 6988-61-0.
What is the molecular formula of 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside?
The molecular formula of 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside is C18H25N3O9.
What is the molecular weight of 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside?
The molecular weight of 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside is 427.16 g/mol.
Where can I buy 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside?
You can request a quote for 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-trihydroxy-1-(2-phenyl-2H-1,2,3-triazol-4-yl)butan-2-yl hexopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.