Dibutoline Sulfate
TL;DR: Dibutoline Sulfate (CAS 532-49-0) is a chemical compound with molecular formula C30H66N4O8S and molecular weight 642.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-(dibutylcarbamoyloxy)ethyl-ethyl-dimethylazanium);sulfate
Also Known As: Dibutoline sulfate, Dibuline sulfate, Dibutoline sulphate, Di-n-butyl-carbamylcholine sulphate, DIBUTOLINE SULFATE [MI]
| Molecular Formula | C30H66N4O8S |
|---|---|
| Molecular Weight | 642.46 g/mol |
| LogP | 4.91 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 22 |
| Exact Mass | 642.46014 |
| Heavy Atoms | 43 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 532-49-0 |
|---|---|
| SMILES | CCCCN(CCCC)C(=O)OCC[N+](C)(C)CC.CCCCN(CCCC)C(=O)OCC[N+](C)(C)CC.[O-]S(=O)(=O)[O-] |
| InChIKey | YRPPIMNBOSCROA-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibutoline Sulfate (CAS 532-49-0), with molecular formula C30H66N4O8S and molecular weight 642.46 g/mol. IUPAC: bis(2-(dibutylcarbamoyloxy)ethyl-ethyl-dimethylazanium);sulfate.
Chemical Property Profile of Dibutoline Sulfate
Property Insights of Dibutoline Sulfate
The XLogP value of 4.91 indicates that Dibutoline Sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 148.0 Ų indicates high polarity, suggesting Dibutoline Sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dibutoline Sulfate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dibutoline Sulfate?
The CAS number of Dibutoline Sulfate is 532-49-0.
What is the molecular formula of Dibutoline Sulfate?
The molecular formula of Dibutoline Sulfate is C30H66N4O8S.
What is the molecular weight of Dibutoline Sulfate?
The molecular weight of Dibutoline Sulfate is 642.46 g/mol.
Where can I buy Dibutoline Sulfate?
You can request a quote for Dibutoline Sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibutoline Sulfate?
Yes, KEHONG BIO provides custom synthesis services for Dibutoline Sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.