4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile
TL;DR: 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile (CAS 151693-69-5) 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.
4,5,6-trimethyl-2-methylsulfanylpyridine-3-carbonitrile
Also Known As: 4,5,6-Trimethyl-2-(methylthio)nicotinonitrile, 4,5,6-trimethyl-2-methylsulfanylpyridine-3-carbonitrile, 4,5,6-trimethyl-2-(methylsulfanyl)nicotinonitrile, AE-848/32950038, 4,5,6-trimethyl-2-(methylsulfanyl)pyridine-3-carbonitrile
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H12N2S |
| Molecular Weight | 192.07211 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 62.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.07211 Da |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
| SMILES | CC1=C(C(=C(N=C1C)SC)C#N)C |
| InChIKey | FKJDMXNHTLVWMD-UHFFFAOYSA-N |
Chemical Property Profile of 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile
Property Insights of 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile. The TPSA of 62.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile. Following Lipinski's Rule of Five, 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile has 0 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 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile?
The CAS number of 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile is 151693-69-5.
What is the molecular formula of 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile?
The molecular formula of 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile is C10H12N2S.
What is the molecular weight of 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile?
The molecular weight of 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile is 192.07211 g/mol.
Where can I buy 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile?
You can request a quote for 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 4,5,6-Trimethyl-2-methylsulfanylpyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.