![2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile structure](/static/products/3270/327068-36-0.webp)
2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile
TL;DR: 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile (CAS 327068-36-0) is a chemical compound with molecular formula C16H9N3S3 and molecular weight 338.99585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(cyanomethylsulfanyl)-4,6-dithiophen-2-ylpyridine-3-carbonitrile
Also Known As: AN-329/40839954, 2-[(cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile, 2-[(cyanomethyl)thio]-4,6-dithien-2-ylnicotinonitrile, 2-(cyanomethylsulfanyl)-4,6-dithiophen-2-ylpyridine-3-carbonitrile, 2-[(cyanomethyl)sulfanyl]-4,6-di-2-thienylnicotinonitrile
Technical Specifications
| Molecular Formula | C16H9N3S3 |
| Molecular Weight | 338.99585 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.99585 Da |
| Heavy Atoms | 22 |
| Complexity | 480.0 |
| SMILES | C1=CSC(=C1)C2=CC(=NC(=C2C#N)SCC#N)C3=CC=CS3 |
| InChIKey | ADVQXMMPQZQHBW-UHFFFAOYSA-N |
Chemical Property Profile of 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile
Property Insights of 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile
The XLogP value of 3.9 indicates that 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
The CAS number of 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile is 327068-36-0.
What is the molecular formula of 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
The molecular formula of 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile is C16H9N3S3.
What is the molecular weight of 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
The molecular weight of 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile is 338.99585 g/mol.
Where can I buy 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
You can request a quote for 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile?
Yes, CoreyChem provides custom synthesis services for 2-[(Cyanomethyl)sulfanyl]-4,6-di(2-thienyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.