![4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile structure](/static/products/3127/312758-26-2.webp)
4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile
TL;DR: 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile (CAS 312758-26-2) is a chemical compound with molecular formula C15H14N2OS2 and molecular weight 302.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6-trimethyl-2-(2-oxo-2-thiophen-2-ylethyl)sulfanylpyridine-3-carbonitrile
Also Known As: 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile, 4,5,6-trimethyl-2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}pyridine-3-carbonitrile, 4,5,6-trimethyl-2-(2-oxo-2-thiophen-2-ylethyl)sulfanylpyridine-3-carbonitrile, 4,5,6-trimethyl-2-{[2-oxo-2-(2-thienyl)ethyl]thio}nicotinonitrile, 4,5,6-trimethyl-2-((2-oxo-2-(thiophen-2-yl)ethyl)thio)nicotinonitrile
| Molecular Formula | C15H14N2OS2 |
|---|---|
| Molecular Weight | 302.05 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.05475 |
| Heavy Atoms | 20 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 312758-26-2 |
|---|---|
| SMILES | CC1=C(C(=C(N=C1C)SCC(=O)C2=CC=CS2)C#N)C |
| InChIKey | RKJZUILBUSXHGW-UHFFFAOYSA-N |
Product Overview
4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile (CAS 312758-26-2), with molecular formula C15H14N2OS2 and molecular weight 302.05 g/mol. IUPAC: 4,5,6-trimethyl-2-(2-oxo-2-thiophen-2-ylethyl)sulfanylpyridine-3-carbonitrile.
Chemical Property Profile of 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile
Property Insights of 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile
The XLogP value of 4.0 indicates that 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile. Following Lipinski's Rule of Five, 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile 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 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile?
The CAS number of 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile is 312758-26-2.
What is the molecular formula of 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile?
The molecular formula of 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile is C15H14N2OS2.
What is the molecular weight of 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile?
The molecular weight of 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile is 302.05 g/mol.
Where can I buy 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile?
You can request a quote for 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6-Trimethyl-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-3-pyridinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.