5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile
TL;DR: 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile (CAS 151693-66-2) is a chemical compound with molecular formula C10H12N2S and molecular weight 192.07211 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile
Also Known As: TimTec1_005434, 5-ethyl-2-mercapto-4,6-dimethylnicotinonitrile, 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile, 5-ethyl-4,6-dimethyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile, AE-848/33206048
Technical Specifications
| Molecular Formula | C10H12N2S |
| Molecular Weight | 192.07211 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.07211 Da |
| Heavy Atoms | 13 |
| Complexity | 366.0 |
| SMILES | CCC1=C(NC(=S)C(=C1C)C#N)C |
| InChIKey | IMLGWNWCXQYTLB-UHFFFAOYSA-N |
Chemical Property Profile of 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile
Property Insights of 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile. Following Lipinski's Rule of Five, 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile?
The CAS number of 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile is 151693-66-2.
What is the molecular formula of 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile?
The molecular formula of 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile is C10H12N2S.
What is the molecular weight of 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile?
The molecular weight of 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile is 192.07211 g/mol.
Where can I buy 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile?
You can request a quote for 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.