6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile
TL;DR: 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile (CAS 128970-24-1) is a chemical compound with molecular formula C13H12N2OS and molecular weight 244.06703 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile
Also Known As: BAS 00635162, 2-(Methylsulfanyl)-6-oxo-4-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile, 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile, 2-methylthio-6-oxo-4-phenyl-1,4,5-trihydropyridine-3-carbonitrile, 2-(Methylthio)-6-oxo-4-phenyl-1,4,5,6-tetrahydro-3-pyridinecarbonitrile
Technical Specifications
| Molecular Formula | C13H12N2OS |
| Molecular Weight | 244.06703 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.06703 Da |
| Heavy Atoms | 17 |
| Complexity | 387.0 |
| SMILES | CSC1=C(C(CC(=O)N1)C2=CC=CC=C2)C#N |
| InChIKey | GITRNMVQQFFZHQ-UHFFFAOYSA-N |
Chemical Property Profile of 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile
Property Insights of 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-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-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile?
The CAS number of 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile is 128970-24-1.
What is the molecular formula of 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile?
The molecular formula of 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile is C13H12N2OS.
What is the molecular weight of 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile?
The molecular weight of 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile is 244.06703 g/mol.
Where can I buy 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile?
You can request a quote for 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.