Zoniporide mesylate
TL;DR: Zoniporide mesylate (CAS 249296-45-5) is a chemical compound with molecular formula C18H20N6O4S and molecular weight 416.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyclopropyl-N-(diaminomethylidene)-1-quinolin-5-ylpyrazole-4-carboxamide;methanesulfonic acid
Also Known As: Zoniporide mesylate, Zoniporide mesilate, Zoniporide mesylate [USAN], Zoniporide mesylate (INN/USAN), CP-597,396-27
| Molecular Formula | C18H20N6O4S |
|---|---|
| Molecular Weight | 416.13 g/mol |
| LogP | 1.2155 |
| Topological Polar Surface Area | 166.55 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 416.12668 |
| Heavy Atoms | 29 |
| Complexity | 1180.7866 |
Chemical Identifiers
| CAS Number | 249296-45-5 |
|---|---|
| SMILES | CS(=O)(=O)O.C1CC1C2=C(C=NN2C3=CC=CC4=C3C=CC=N4)C(=O)N=C(N)N |
Product Overview
Zoniporide mesylate (CAS 249296-45-5), with molecular formula C18H20N6O4S and molecular weight 416.13 g/mol. IUPAC: 5-cyclopropyl-N-(diaminomethylidene)-1-quinolin-5-ylpyrazole-4-carboxamide;methanesulfonic acid.
Chemical Property Profile of Zoniporide mesylate
Property Insights of Zoniporide mesylate
The XLogP value of 1.2155 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Zoniporide mesylate. The TPSA of 166.55 Ų indicates high polarity, suggesting Zoniporide mesylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Zoniporide mesylate has 3 hydrogen bond donor(s) and 5 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 Zoniporide mesylate?
The CAS number of Zoniporide mesylate is 249296-45-5.
What is the molecular formula of Zoniporide mesylate?
The molecular formula of Zoniporide mesylate is C18H20N6O4S.
What is the molecular weight of Zoniporide mesylate?
The molecular weight of Zoniporide mesylate is 416.13 g/mol.
Where can I buy Zoniporide mesylate?
You can request a quote for Zoniporide mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Zoniporide mesylate?
Yes, KEHONG BIO provides custom synthesis services for Zoniporide mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.