![3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile structure](/static/products/155/155474-02-5.png)
3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile
TL;DR: 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile (CAS 155474-02-5) is a chemical compound with molecular formula C17H24N4OS and molecular weight 332.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-8-(4-methylpiperazin-1-yl)-6-methylsulfanyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile, 3,3-dimethyl-8-(4-methylpiperazin-1-yl)-6-(methylsulfanyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-8-(4-methylpiperazin-1-yl)-6-(methylthio)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-8-(4-methylpiperazin-1-yl)-6-methylsulfanyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-8-(4-methylpiperazinyl)-6-methylthio-3,4-dihydro-1H-pyrano[3,4-c] pyridine-5-carbonitrile
| Molecular Formula | C17H24N4OS |
|---|---|
| Molecular Weight | 332.17 g/mol |
| LogP | 2.27828 |
| Topological Polar Surface Area | 52.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.16708 |
| Heavy Atoms | 23 |
| Complexity | 644.97394 |
Chemical Identifiers
| CAS Number | 155474-02-5 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=NC(=C2C#N)SC)N3CCN(CC3)C)C |
Product Overview
3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile (CAS 155474-02-5), with molecular formula C17H24N4OS and molecular weight 332.17 g/mol. IUPAC: 3,3-dimethyl-8-(4-methylpiperazin-1-yl)-6-methylsulfanyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile
Property Insights of 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile
The XLogP value of 2.27828 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile. With a topological polar surface area (TPSA) of 52.39 Ų, 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile?
The CAS number of 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile is 155474-02-5.
What is the molecular formula of 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile?
The molecular formula of 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile is C17H24N4OS.
What is the molecular weight of 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile?
The molecular weight of 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile is 332.17 g/mol.
Where can I buy 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile?
You can request a quote for 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-6-methylsulfanyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbo nitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.