Quinuronium methylsulfate
TL;DR: Quinuronium methylsulfate (CAS 135-14-8) is a chemical compound with molecular formula C23H26N4O9S2 and molecular weight 566.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(1-methylquinolin-1-ium-6-yl)urea;methyl sulfate
Also Known As: Pyroplasmin, Zothelone, Acaprin, Baburan, Pirevan
| Molecular Formula | C23H26N4O9S2 |
|---|---|
| Molecular Weight | 566.11 g/mol |
| LogP | 1.47 |
| Topological Polar Surface Area | 199.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 566.11414 |
| Heavy Atoms | 38 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 135-14-8 |
|---|---|
| SMILES | C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)NC3=CC4=C(C=C3)[N+](=CC=C4)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-] |
| InChIKey | BOMUADPKDXMXIH-UHFFFAOYSA-M |
Product Overview
Quinuronium methylsulfate (CAS 135-14-8), with molecular formula C23H26N4O9S2 and molecular weight 566.11 g/mol. IUPAC: 1,3-bis(1-methylquinolin-1-ium-6-yl)urea;methyl sulfate.
Chemical Property Profile of Quinuronium methylsulfate
Property Insights of Quinuronium methylsulfate
The XLogP value of 1.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinuronium methylsulfate. The TPSA of 199.0 Ų indicates high polarity, suggesting Quinuronium methylsulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quinuronium methylsulfate has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Quinuronium methylsulfate?
The CAS number of Quinuronium methylsulfate is 135-14-8.
What is the molecular formula of Quinuronium methylsulfate?
The molecular formula of Quinuronium methylsulfate is C23H26N4O9S2.
What is the molecular weight of Quinuronium methylsulfate?
The molecular weight of Quinuronium methylsulfate is 566.11 g/mol.
Where can I buy Quinuronium methylsulfate?
You can request a quote for Quinuronium methylsulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinuronium methylsulfate?
Yes, KEHONG BIO provides custom synthesis services for Quinuronium methylsulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.