Pirralkonium
TL;DR: Pirralkonium (CAS 17794-63-7) is a chemical compound with molecular formula C35H72N3+ and molecular weight 534.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[3-(2,5-dimethylpyrrolidin-1-yl)propyl]-hexadecyl-methylazanium
Also Known As: Pirralkonium, Pirralkonium ion, Pirralkonium cation, Bis(3-(2,5-dimethyl-1-pyrrolidinyl)propyl)hexadecylmethylammonium, Ammonium, bis(3-(2,5-dimethyl-1-pyrrolidinyl)propyl)hexadecylmethyl-
| Molecular Formula | C35H72N3+ |
|---|---|
| Molecular Weight | 534.57 g/mol |
| LogP | 11.5 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 23 |
| Exact Mass | 534.57263 |
| Heavy Atoms | 38 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 17794-63-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC[N+](C)(CCCN1C(CCC1C)C)CCCN2C(CCC2C)C |
| InChIKey | VMIYNXFWQJSJDA-UHFFFAOYSA-N |
Product Overview
Pirralkonium (CAS 17794-63-7), with molecular formula C35H72N3+ and molecular weight 534.57 g/mol. IUPAC: bis[3-(2,5-dimethylpyrrolidin-1-yl)propyl]-hexadecyl-methylazanium.
Chemical Property Profile of Pirralkonium
Property Insights of Pirralkonium
The XLogP value of 11.5 indicates that Pirralkonium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, Pirralkonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pirralkonium has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pirralkonium?
The CAS number of Pirralkonium is 17794-63-7.
What is the molecular formula of Pirralkonium?
The molecular formula of Pirralkonium is C35H72N3+.
What is the molecular weight of Pirralkonium?
The molecular weight of Pirralkonium is 534.57 g/mol.
Where can I buy Pirralkonium?
You can request a quote for Pirralkonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pirralkonium?
Yes, KEHONG BIO provides custom synthesis services for Pirralkonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.