![1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone structure](/static/products/4780/478047-32-4.webp)
1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone
TL;DR: 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone (CAS 478047-32-4) is a chemical compound with molecular formula C16H12N4O2 and molecular weight 292.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[4-(pyridine-2-carbonyl)triazol-1-yl]phenyl]ethanone
Also Known As: 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone, 1-[4-[4-(pyridine-2-carbonyl)triazol-1-yl]phenyl]ethanone, 1-{4-[4-(pyridine-2-carbonyl)-1H-1,2,3-triazol-1-yl]phenyl}ethan-1-one, 4R-0816
| Molecular Formula | C16H12N4O2 |
|---|---|
| Molecular Weight | 292.10 g/mol |
| LogP | 2.0959 |
| Topological Polar Surface Area | 77.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.09604 |
| Heavy Atoms | 22 |
| Complexity | 822.8668 |
Chemical Identifiers
| CAS Number | 478047-32-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)N2C=C(N=N2)C(=O)C3=CC=CC=N3 |
Product Overview
1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone (CAS 478047-32-4), with molecular formula C16H12N4O2 and molecular weight 292.10 g/mol. IUPAC: 1-[4-[4-(pyridine-2-carbonyl)triazol-1-yl]phenyl]ethanone.
Chemical Property Profile of 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone
Property Insights of 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone
The XLogP value of 2.0959 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone. The TPSA of 77.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone. Following Lipinski's Rule of Five, 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone has 0 hydrogen bond donor(s) and 5 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-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone?
The CAS number of 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone is 478047-32-4.
What is the molecular formula of 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone?
The molecular formula of 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone is C16H12N4O2.
What is the molecular weight of 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone?
The molecular weight of 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone is 292.10 g/mol.
Where can I buy 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone?
You can request a quote for 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-{4-[4-(2-pyridinylcarbonyl)-1H-1,2,3-triazol-1-yl]phenyl}-1-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.