Dibutoline
TL;DR: Dibutoline (CAS 21962-82-3) is a chemical compound with molecular formula C15H33N2O2+ and molecular weight 273.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dibutylcarbamoyloxy)ethyl-ethyl-dimethylazanium
Also Known As: Dibutoline, Dibuline, Dibutoline ion, Dibutoline cation, 2-(dibutylcarbamoyloxy)ethyl-ethyl-dimethylazanium
| Molecular Formula | C15H33N2O2+ |
|---|---|
| Molecular Weight | 273.25 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 273.2542 |
| Heavy Atoms | 19 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 21962-82-3 |
|---|---|
| SMILES | CCCCN(CCCC)C(=O)OCC[N+](C)(C)CC |
| InChIKey | SDEXVKFYBBHUKN-UHFFFAOYSA-N |
Product Overview
Dibutoline (CAS 21962-82-3), with molecular formula C15H33N2O2+ and molecular weight 273.25 g/mol. IUPAC: 2-(dibutylcarbamoyloxy)ethyl-ethyl-dimethylazanium.
Chemical Property Profile of Dibutoline
Property Insights of Dibutoline
The XLogP value of 3.0 indicates that Dibutoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Dibutoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibutoline has 0 hydrogen bond donor(s) and 2 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 Dibutoline?
The CAS number of Dibutoline is 21962-82-3.
What is the molecular formula of Dibutoline?
The molecular formula of Dibutoline is C15H33N2O2+.
What is the molecular weight of Dibutoline?
The molecular weight of Dibutoline is 273.25 g/mol.
Where can I buy Dibutoline?
You can request a quote for Dibutoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibutoline?
Yes, KEHONG BIO provides custom synthesis services for Dibutoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.