![3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile structure](/static/products/138/138292-15-6.webp)
3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
TL;DR: 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile (CAS 138292-15-6) is a chemical compound with molecular formula C17H16N2OS and molecular weight 296.09833 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3-dimethyl-6-oxo-8-phenyl-4,7-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-6-oxo-8-phenyl-4,7-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Technical Specifications
| Molecular Formula | C17H16N2OS |
| Molecular Weight | 296.09833 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.09833 Da |
| Heavy Atoms | 21 |
| Complexity | 585.0 |
| SMILES | CC1(CC2=C(C(=O)NC(=C2CS1)C3=CC=CC=C3)C#N)C |
| InChIKey | IPKOCZSDVPANMQ-UHFFFAOYSA-N |
Chemical Property Profile of 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Property Insights of 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]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 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The CAS number of 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is 138292-15-6.
What is the molecular formula of 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The molecular formula of 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is C17H16N2OS.
What is the molecular weight of 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The molecular weight of 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is 296.09833 g/mol.
Where can I buy 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
You can request a quote for 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 3,3-dimethyl-6-oxo-8-phenyl-3,4,6,7-tetrahydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.