4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile
TL;DR: 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile (CAS 290829-63-9) is a chemical compound with molecular formula C25H18N2O2S and molecular weight 410.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(furan-2-yl)-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-6-phenylpyridine-3-carbonitrile
Also Known As: 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile, 4-(furan-2-yl)-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-6-phenylpyridine-3-carbonitrile, 4-(furan-2-yl)-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-6-phenylpyridine-3-carbonitrile
| Molecular Formula | C25H18N2O2S |
|---|---|
| Molecular Weight | 410.11 g/mol |
| LogP | 6.1637 |
| Topological Polar Surface Area | 66.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.1089 |
| Heavy Atoms | 30 |
| Complexity | 1208.7507 |
Chemical Identifiers
| CAS Number | 290829-63-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=CO4)C#N |
Product Overview
4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile (CAS 290829-63-9), with molecular formula C25H18N2O2S and molecular weight 410.11 g/mol. IUPAC: 4-(furan-2-yl)-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-6-phenylpyridine-3-carbonitrile.
Chemical Property Profile of 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile
Property Insights of 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile
The XLogP value of 6.1637 indicates that 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile. Following Lipinski's Rule of Five, 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile?
The CAS number of 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile is 290829-63-9.
What is the molecular formula of 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile?
The molecular formula of 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile is C25H18N2O2S.
What is the molecular weight of 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile?
The molecular weight of 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile is 410.11 g/mol.
Where can I buy 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile?
You can request a quote for 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(furan-2-yl)-2-((2-oxo-2-(p-tolyl)ethyl)thio)-6-phenylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.