![4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine structure](/static/products/168/168289-78-9.png)
4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine
TL;DR: 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine (CAS 168289-78-9) is a chemical compound with molecular formula C27H15N3 and molecular weight 381.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[3,5-bis(2-pyridin-4-ylethynyl)phenyl]ethynyl]pyridine
Also Known As: 1,3,5-tris(pyridin-4-ylethynyl)benzene, 1,3,5-tris(4-pyridylethynyl)benzene, 1,3,5-Tris(4-pyridinylethynyl)benzene, 1,3,5-Tris[(4-pyridyl)ethynyl]benzene, Pyridine, 4,4',4''-(1,3,5-benzenetriyltri-2,1-ethynediyl)tris-
| Molecular Formula | C27H15N3 |
|---|---|
| Molecular Weight | 381.13 g/mol |
| LogP | 4.071 |
| Topological Polar Surface Area | 38.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 381.1266 |
| Heavy Atoms | 30 |
| Complexity | 1144.1857 |
Chemical Identifiers
| CAS Number | 168289-78-9 |
|---|---|
| SMILES | C1=CN=CC=C1C#CC2=CC(=CC(=C2)C#CC3=CC=NC=C3)C#CC4=CC=NC=C4 |
Product Overview
4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine (CAS 168289-78-9), with molecular formula C27H15N3 and molecular weight 381.13 g/mol. IUPAC: 4-[2-[3,5-bis(2-pyridin-4-ylethynyl)phenyl]ethynyl]pyridine.
Chemical Property Profile of 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine
Property Insights of 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine
The XLogP value of 4.071 indicates that 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.67 Ų, 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine has 0 hydrogen bond donor(s) and 3 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 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine?
The CAS number of 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine is 168289-78-9.
What is the molecular formula of 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine?
The molecular formula of 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine is C27H15N3.
What is the molecular weight of 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine?
The molecular weight of 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine is 381.13 g/mol.
Where can I buy 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine?
You can request a quote for 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine?
Yes, KEHONG BIO provides custom synthesis services for 4,4',4''-[(Benzene-1,3,5-triyl)triethyne-2,1-diyl]tripyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.