2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine
TL;DR: 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine (CAS 374702-20-2) is a chemical compound with molecular formula C24H31NO and molecular weight 349.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-butoxyphenyl)ethynyl]-5-heptylpyridine
Also Known As: 2-((4-butoxyphenyl)ethynyl)-5-heptylpyridine, 2-[2-(4-butoxyphenyl)ethynyl]-5-heptylpyridine, 2-[2-(4-butoxyphenyl)ethynyl]-5-heptyl-pyridine
| Molecular Formula | C24H31NO |
|---|---|
| Molecular Weight | 349.24 g/mol |
| LogP | 6.1732 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 349.24057 |
| Heavy Atoms | 26 |
| Complexity | 676.89087 |
Chemical Identifiers
| CAS Number | 374702-20-2 |
|---|---|
| SMILES | CCCCCCCC1=CN=C(C=C1)C#CC2=CC=C(C=C2)OCCCC |
Product Overview
2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine (CAS 374702-20-2), with molecular formula C24H31NO and molecular weight 349.24 g/mol. IUPAC: 2-[2-(4-butoxyphenyl)ethynyl]-5-heptylpyridine.
Chemical Property Profile of 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine
Property Insights of 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine
The XLogP value of 6.1732 indicates that 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine 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 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine?
The CAS number of 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine is 374702-20-2.
What is the molecular formula of 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine?
The molecular formula of 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine is C24H31NO.
What is the molecular weight of 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine?
The molecular weight of 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine is 349.24 g/mol.
Where can I buy 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine?
You can request a quote for 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Butoxyphenyl)ethynyl)-5-heptylpyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.