4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile
TL;DR: 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile (CAS 312758-02-4) is a chemical compound with molecular formula C28H22N2O3S and molecular weight 466.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile
Also Known As: BAS 00635187, 4,6-bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile, 4,6-bis(4-methoxyphenyl)-2-((2-oxo-2-phenylethyl)thio)nicotinonitrile, 4,6-bis(4-methoxyphenyl)-2-(2-oxo-2-phenylethylthio)pyridine-3-carbonitrile, 4,6-bis(4-methoxyphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]pyridine-3-carbonitrile
| Molecular Formula | C28H22N2O3S |
|---|---|
| Molecular Weight | 466.14 g/mol |
| LogP | 6.27948 |
| Topological Polar Surface Area | 72.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 466.1351 |
| Heavy Atoms | 34 |
| Complexity | 1329.4376 |
Chemical Identifiers
| CAS Number | 312758-02-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC |
Product Overview
4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile (CAS 312758-02-4), with molecular formula C28H22N2O3S and molecular weight 466.14 g/mol. IUPAC: 4,6-bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile.
Chemical Property Profile of 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile
Property Insights of 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile
The XLogP value of 6.27948 indicates that 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile. Following Lipinski's Rule of Five, 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile?
The CAS number of 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile is 312758-02-4.
What is the molecular formula of 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile?
The molecular formula of 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile is C28H22N2O3S.
What is the molecular weight of 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile?
The molecular weight of 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile is 466.14 g/mol.
Where can I buy 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile?
You can request a quote for 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.