![[4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate structure](/static/products/6547/6547-32-6.webp)
[4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate
TL;DR: [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate (CAS 6547-32-6) is a chemical compound with molecular formula C27H22N6O3 and molecular weight 478.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] pyridine-3-carboxylate
Also Known As: [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate|4-{2-Cyano-2-[5-(morpholin-4-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]ethen-1-yl}phenyl pyridine-3-carboxylate
| Molecular Formula | C27H22N6O3 |
|---|---|
| Molecular Weight | 478.18 g/mol |
| LogP | 3.78228 |
| Topological Polar Surface Area | 106.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.17532 |
| Heavy Atoms | 36 |
| Complexity | 1403.6567 |
Chemical Identifiers
| CAS Number | 6547-32-6 |
|---|---|
| SMILES | C1COCCN1C2=NN=C(N2C3=CC=CC=C3)C(=CC4=CC=C(C=C4)OC(=O)C5=CN=CC=C5)C#N |
Product Overview
[4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate (CAS 6547-32-6), with molecular formula C27H22N6O3 and molecular weight 478.18 g/mol. IUPAC: [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] pyridine-3-carboxylate.
Chemical Property Profile of [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate
Property Insights of [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate
The XLogP value of 3.78228 indicates that [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.16 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate. Following Lipinski's Rule of Five, [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate has 0 hydrogen bond donor(s) and 8 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-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate?
The CAS number of [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate is 6547-32-6.
What is the molecular formula of [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate?
The molecular formula of [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate is C27H22N6O3.
What is the molecular weight of [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate?
The molecular weight of [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate is 478.18 g/mol.
Where can I buy [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate?
You can request a quote for [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [4-[2-cyano-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethenyl]phenyl] Pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.