![4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile structure](/static/products/4453/445384-83-8.webp)
4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile
TL;DR: 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile (CAS 445384-83-8) is a chemical compound with molecular formula C17H18N2S and molecular weight 282.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6-trimethyl-2-(2-phenylethylsulfanyl)pyridine-3-carbonitrile
Also Known As: 4,5,6-trimethyl-2-(phenethylthio)nicotinonitrile, AM-807/14958491, 4,5,6-trimethyl-2-[(2-phenylethyl)sulfanyl]nicotinonitrile, 4,5,6-trimethyl-2-phenethylsulfanylpyridine-3-carbonitrile, 4,5,6-trimethyl-2-(2-phenylethylsulfanyl)pyridine-3-carbonitrile
| Molecular Formula | C17H18N2S |
|---|---|
| Molecular Weight | 282.12 g/mol |
| LogP | 4.21334 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.11908 |
| Heavy Atoms | 20 |
| Complexity | 642.27496 |
Chemical Identifiers
| CAS Number | 445384-83-8 |
|---|---|
| SMILES | CC1=C(C(=C(N=C1C)SCCC2=CC=CC=C2)C#N)C |
Product Overview
4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile (CAS 445384-83-8), with molecular formula C17H18N2S and molecular weight 282.12 g/mol. IUPAC: 4,5,6-trimethyl-2-(2-phenylethylsulfanyl)pyridine-3-carbonitrile.
Chemical Property Profile of 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile
Property Insights of 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile
The XLogP value of 4.21334 indicates that 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-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
Frequently Asked Questions
What is the CAS number of 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile?
The CAS number of 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile is 445384-83-8.
What is the molecular formula of 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile?
The molecular formula of 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile is C17H18N2S.
What is the molecular weight of 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile?
The molecular weight of 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile is 282.12 g/mol.
Where can I buy 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile?
You can request a quote for 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6-Trimethyl-2-[(2-phenylethyl)sulfanyl]pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.