![2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile structure](/static/products/372/372173-52-9.png)
2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
TL;DR: 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile (CAS 372173-52-9) is a chemical compound with molecular formula C22H18N2OS and molecular weight 358.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylpyridine-3-carbonitrile
Also Known As: AE-848/32310036, 2-((2-([1,1'-biphenyl]-4-yl)-2-oxoethyl)thio)-4,6-dimethylnicotinonitrile, 2-[(2-[1,1'-biphenyl]-4-yl-2-oxoethyl)sulfanyl]-4,6-dimethylnicotinonitrile, 2-{[2-(biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile, 4,6-dimethyl-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylpyridine-3-carbonitrile
| Molecular Formula | C22H18N2OS |
|---|---|
| Molecular Weight | 358.11 g/mol |
| LogP | 5.21212 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.11398 |
| Heavy Atoms | 26 |
| Complexity | 973.5192 |
Chemical Identifiers
| CAS Number | 372173-52-9 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C#N)SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C |
Product Overview
2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile (CAS 372173-52-9), with molecular formula C22H18N2OS and molecular weight 358.11 g/mol. IUPAC: 4,6-dimethyl-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylpyridine-3-carbonitrile.
Chemical Property Profile of 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
Property Insights of 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
The XLogP value of 5.21212 indicates that 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.75 Ų, 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile?
The CAS number of 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile is 372173-52-9.
What is the molecular formula of 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile?
The molecular formula of 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile is C22H18N2OS.
What is the molecular weight of 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile?
The molecular weight of 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile is 358.11 g/mol.
Where can I buy 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile?
You can request a quote for 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-(Biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.