6-Sulfanyl-2,3'-bipyridine-5-carbonitrile
TL;DR: 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile (CAS 118947-87-8) is a chemical compound with molecular formula C11H7N3S and molecular weight 213.03607 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-pyridin-3-yl-2-sulfanylidene-1H-pyridine-3-carbonitrile
Also Known As: 6-sulfanyl-2,3'-bipyridine-5-carbonitrile, 6-(3-pyridyl)-3-cyanopyridine-2(1h)-thione, 6-thioxo-1,6-dihydro-2,3'-bipyridine-5-carbonitrile, 6-(3-pyridyl)-2-thioxohydropyridine-3-carbonitrile, 6-(pyridine-2-yl)-3-cyanopyridine-2-(1H)-thione
Technical Specifications
| Molecular Formula | C11H7N3S |
| Molecular Weight | 213.03607 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 80.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 213.03607 Da |
| Heavy Atoms | 15 |
| Complexity | 386.0 |
| SMILES | C1=CC(=CN=C1)C2=CC=C(C(=S)N2)C#N |
| InChIKey | PREZJTKROSTHFW-UHFFFAOYSA-N |
Chemical Property Profile of 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile
Property Insights of 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile. The TPSA of 80.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile. Following Lipinski's Rule of Five, 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile?
The CAS number of 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile is 118947-87-8.
What is the molecular formula of 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile?
The molecular formula of 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile is C11H7N3S.
What is the molecular weight of 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile?
The molecular weight of 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile is 213.03607 g/mol.
Where can I buy 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile?
You can request a quote for 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 6-Sulfanyl-2,3'-bipyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.