![1-[(4-Methoxyphenyl)methyl]pyridin-1-ium structure](/static/products/4644/46441-13-8.webp)
1-[(4-Methoxyphenyl)methyl]pyridin-1-ium
TL;DR: 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium (CAS 46441-13-8) is a chemical compound with molecular formula C13H14NO+ and molecular weight 200.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methoxyphenyl)methyl]pyridin-1-ium
Also Known As: p-methoxy benzylpyridinium, NCIOpen2_005117, 1-(p-Methoxybenzyl)pyridinium, 1-(4-Methoxybenzyl)pyridinium, 1-[(4-methoxyphenyl)methyl]pyridin-1-ium
| Molecular Formula | C13H14NO+ |
|---|---|
| Molecular Weight | 200.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.10754 |
| Heavy Atoms | 15 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 46441-13-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C[N+]2=CC=CC=C2 |
| InChIKey | IFFBKZAYSFHSFE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[(4-Methoxyphenyl)methyl]pyridin-1-ium (CAS 46441-13-8), with molecular formula C13H14NO+ and molecular weight 200.11 g/mol. IUPAC: 1-[(4-methoxyphenyl)methyl]pyridin-1-ium.
Chemical Property Profile of 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium
Property Insights of 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium. With a topological polar surface area (TPSA) of 13.1 Ų, 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium has 0 hydrogen bond donor(s) and 1 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 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium?
The CAS number of 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium is 46441-13-8.
What is the molecular formula of 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium?
The molecular formula of 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium is C13H14NO+.
What is the molecular weight of 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium?
The molecular weight of 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium is 200.11 g/mol.
Where can I buy 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium?
You can request a quote for 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Methoxyphenyl)methyl]pyridin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.