2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile
TL;DR: 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile (CAS 607699-56-9) is a chemical compound with molecular formula C17H12N2OS and molecular weight 292.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile
Also Known As: 2-(benzylthio)-6-(2-furyl)nicotinonitrile, 2-(benzylthio)-6-(furan-2-yl)nicotinonitrile, 2-benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile, 6-(2-furyl)-2-(phenylmethylthio)pyridine-3-carbonitrile, 2-(benzylsulfanyl)-6-(furan-2-yl)pyridine-3-carbonitrile
| Molecular Formula | C17H12N2OS |
|---|---|
| Molecular Weight | 292.07 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 75.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.06705 |
| Heavy Atoms | 21 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 607699-56-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=C(C=CC(=N2)C3=CC=CO3)C#N |
| InChIKey | KXXYTOAXMLSIDO-UHFFFAOYSA-N |
Product Overview
2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile (CAS 607699-56-9), with molecular formula C17H12N2OS and molecular weight 292.07 g/mol. IUPAC: 2-benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile.
Chemical Property Profile of 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile
Property Insights of 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile
The XLogP value of 3.7 indicates that 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile. Following Lipinski's Rule of Five, 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile has 0 hydrogen bond donor(s) and 4 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 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile?
The CAS number of 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile is 607699-56-9.
What is the molecular formula of 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile?
The molecular formula of 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile is C17H12N2OS.
What is the molecular weight of 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile?
The molecular weight of 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile is 292.07 g/mol.
Where can I buy 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile?
You can request a quote for 2-Benzylsulfanyl-6-(furan-2-yl)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 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzylsulfanyl-6-(furan-2-yl)pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.