Pentolinium
TL;DR: Pentolinium (CAS 144-44-5) is a chemical compound with molecular formula C15H32N2+2 and molecular weight 240.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-1-[5-(1-methylpyrrolidin-1-ium-1-yl)pentyl]pyrrolidin-1-ium
Also Known As: Pentolinium, Pentolonium, Pentolonum, pentolineum, pentolinium ion
| Molecular Formula | C15H32N2+2 |
|---|---|
| Molecular Weight | 240.26 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.25655 |
| Heavy Atoms | 17 |
| Complexity | 201.0 |
| Melting Point | 213 |
| Solubility | 1.16e-05 g/L |
Chemical Identifiers
| CAS Number | 144-44-5 |
|---|---|
| SMILES | C[N+]1(CCCC1)CCCCC[N+]2(CCCC2)C |
| InChIKey | XSBSKEQEUFOSDD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentolinium (CAS 144-44-5), with molecular formula C15H32N2+2 and molecular weight 240.26 g/mol. IUPAC: 1-methyl-1-[5-(1-methylpyrrolidin-1-ium-1-yl)pentyl]pyrrolidin-1-ium.
Chemical Property Profile of Pentolinium
Property Insights of Pentolinium
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentolinium. With a topological polar surface area (TPSA) of 0.0 Ų, Pentolinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentolinium has 0 hydrogen bond donor(s) and 0 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 Pentolinium?
The CAS number of Pentolinium is 144-44-5.
What is the molecular formula of Pentolinium?
The molecular formula of Pentolinium is C15H32N2+2.
What is the molecular weight of Pentolinium?
The molecular weight of Pentolinium is 240.26 g/mol.
Where can I buy Pentolinium?
You can request a quote for Pentolinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentolinium?
Yes, KEHONG BIO provides custom synthesis services for Pentolinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.