Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide
TL;DR: Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide (CAS 63884-25-3) is a chemical compound with molecular formula C19H30INO2 and molecular weight 431.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[4-(1-methylpiperidin-1-ium-1-yl)butyl]phenyl] propanoate iodide
Also Known As: Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide, Piperidinium, 1-butyl-4-hydroxy-1-methyl-4-phenyl-, iodide, propionate, hydrochloride, 1-Methyl-1-{4-[4-(propanoyloxy)phenyl]butyl}piperidin-1-ium iodide, [4-[4-(1-methylpiperidin-1-ium-1-yl)butyl]phenyl] propanoate iodide, Piperidinium, 1-methyl-1-[4-[4-(1-oxopropoxy)phenyl]butyl]-, iodide
| Molecular Formula | C19H30INO2 |
|---|---|
| Molecular Weight | 431.13 g/mol |
| LogP | 0.9592 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.13214 |
| Heavy Atoms | 23 |
| Complexity | 466.76288 |
Chemical Identifiers
| CAS Number | 63884-25-3 |
|---|---|
| SMILES | CCC(=O)OC1=CC=C(C=C1)CCCC[N+]2(CCCCC2)C.[I-] |
Product Overview
Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide (CAS 63884-25-3), with molecular formula C19H30INO2 and molecular weight 431.13 g/mol. IUPAC: [4-[4-(1-methylpiperidin-1-ium-1-yl)butyl]phenyl] propanoate iodide.
Chemical Property Profile of Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide
Property Insights of Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide
The XLogP value of 0.9592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide. With a topological polar surface area (TPSA) of 26.3 Ų, Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide 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 Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide?
The CAS number of Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide is 63884-25-3.
What is the molecular formula of Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide?
The molecular formula of Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide is C19H30INO2.
What is the molecular weight of Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide?
The molecular weight of Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide is 431.13 g/mol.
Where can I buy Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide?
You can request a quote for Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Piperidinium, butyl(4-phenyl-4-propionyloxy)methyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.