Clioquinol glucuronide
TL;DR: Clioquinol glucuronide (CAS 34296-97-4) is a chemical compound with molecular formula C15H13ClINO7 and molecular weight 480.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-(5-chloro-7-iodoquinolin-8-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Clioquinol glucuronide, CHINOFORM GLUCURONIDE, 1-phenyl-1H-1,2,3-triazole-4-carboxaldehyde, 5-CHLORO-7-IODO-8-QUINOLINOL GLUCURONIDE, 5-CHLORO-7-IODO-8-QUINOLYL .BETA.-D-GLUCURONIDE
| Molecular Formula | C15H13ClINO7 |
|---|---|
| Molecular Weight | 480.94 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 480.94254 |
| Heavy Atoms | 25 |
| Complexity | 501.0 |
Chemical Identifiers
| CAS Number | 34296-97-4 |
|---|---|
| SMILES | C1=CC2=C(C(=C(C=C2Cl)I)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)N=C1 |
| InChIKey | ZXPACOCAPRBPFP-BPJKLTAVSA-N |
Product Overview
Clioquinol glucuronide (CAS 34296-97-4), with molecular formula C15H13ClINO7 and molecular weight 480.94 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-(5-chloro-7-iodoquinolin-8-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of Clioquinol glucuronide
Property Insights of Clioquinol glucuronide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Clioquinol glucuronide. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Clioquinol glucuronide. Following Lipinski's Rule of Five, Clioquinol glucuronide has 4 hydrogen bond donor(s) and 8 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 Clioquinol glucuronide?
The CAS number of Clioquinol glucuronide is 34296-97-4.
What is the molecular formula of Clioquinol glucuronide?
The molecular formula of Clioquinol glucuronide is C15H13ClINO7.
What is the molecular weight of Clioquinol glucuronide?
The molecular weight of Clioquinol glucuronide is 480.94 g/mol.
Where can I buy Clioquinol glucuronide?
You can request a quote for Clioquinol glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clioquinol glucuronide?
Yes, KEHONG BIO provides custom synthesis services for Clioquinol glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.