2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide
TL;DR: 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide (CAS 67492-46-0) is a chemical compound with molecular formula C21H26N4O10S and molecular weight 526.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(pyridine-2-carbonylamino)carbamothioylamino]oxan-2-yl]methyl acetate
Also Known As: 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide, [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(pyridine-2-carbonylamino)carbamothioylamino]oxan-2-yl]methyl acetate, 2,3,4,6-Tetra-O-acetyl-N-[{2-[hydroxy(pyridin-2-yl)methylidene]hydrazin-1-yl}(sulfanyl)methylidene]-beta-D-glucopyranosylamine, 2,3,4,6-Tetra-O-acetyl-N-[{2-[hydroxy(pyridin-2-yl)methylidene]hydrazinyl}(sulfanyl)methylidene]hexopyranosylamine
| Molecular Formula | C21H26N4O10S |
|---|---|
| Molecular Weight | 526.14 g/mol |
| LogP | -0.7264 |
| Topological Polar Surface Area | 180.48 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 526.13696 |
| Heavy Atoms | 36 |
| Complexity | 992.16956 |
Chemical Identifiers
| CAS Number | 67492-46-0 |
|---|---|
| SMILES | CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)NC(=S)NNC(=O)C2=CC=CC=N2)OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide (CAS 67492-46-0), with molecular formula C21H26N4O10S and molecular weight 526.14 g/mol. IUPAC: [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(pyridine-2-carbonylamino)carbamothioylamino]oxan-2-yl]methyl acetate.
Chemical Property Profile of 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide
Property Insights of 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide
The XLogP value of -0.7264 indicates that 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 180.48 Ų indicates high polarity, suggesting 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide?
The CAS number of 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide is 67492-46-0.
What is the molecular formula of 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide?
The molecular formula of 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide is C21H26N4O10S.
What is the molecular weight of 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide?
The molecular weight of 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide is 526.14 g/mol.
Where can I buy 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide?
You can request a quote for 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyridinecarboxylic acid, 2-(((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)amino)thioxomethyl)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.