Mixidine tosylate
TL;DR: Mixidine tosylate (CAS 67958-12-7) is a chemical compound with molecular formula C22H30N2O5S and molecular weight 434.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylpyrrolidin-2-imine;4-methylbenzenesulfonic acid
Also Known As: Mixidine tosylate, Benzeneethanamine, 3,4-dimethoxy-N-(1-methyl-2-pyrrolidinylidene)-, mono(4-methylbenzenesulfonate), N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylpyrrolidin-2-imine; 4-methylbenzenesulfonic acid
| Molecular Formula | C22H30N2O5S |
|---|---|
| Molecular Weight | 434.19 g/mol |
| LogP | 3.61212 |
| Topological Polar Surface Area | 96.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.18753 |
| Heavy Atoms | 30 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 67958-12-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.CN1CCCC1=NCCC2=CC(=C(C=C2)OC)OC |
| InChIKey | GQCMLAZHLWPIJJ-UHFFFAOYSA-N |
Product Overview
Mixidine tosylate (CAS 67958-12-7), with molecular formula C22H30N2O5S and molecular weight 434.19 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylpyrrolidin-2-imine;4-methylbenzenesulfonic acid.
Chemical Property Profile of Mixidine tosylate
Property Insights of Mixidine tosylate
The XLogP value of 3.61212 indicates that Mixidine tosylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Mixidine tosylate. Following Lipinski's Rule of Five, Mixidine tosylate has 1 hydrogen bond donor(s) and 6 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 Mixidine tosylate?
The CAS number of Mixidine tosylate is 67958-12-7.
What is the molecular formula of Mixidine tosylate?
The molecular formula of Mixidine tosylate is C22H30N2O5S.
What is the molecular weight of Mixidine tosylate?
The molecular weight of Mixidine tosylate is 434.19 g/mol.
Where can I buy Mixidine tosylate?
You can request a quote for Mixidine tosylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mixidine tosylate?
Yes, KEHONG BIO provides custom synthesis services for Mixidine tosylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.