6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile
TL;DR: 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile (CAS 340812-91-1) is a chemical compound with molecular formula C13H11N3S and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-6-pyridin-3-ylpyridine-3-carbonitrile
Also Known As: 6-(ethylsulfanyl)-2,3'-bipyridine-5-carbonitrile, 6-(ethylthio)-[2,3'-bipyridine]-5-carbonitrile, 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile, 2-ethylsulfanyl-6-pyridin-3-ylpyridine-3-carbonitrile
| Molecular Formula | C13H11N3S |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 3.12728 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.06737 |
| Heavy Atoms | 17 |
| Complexity | 546.3362 |
Chemical Identifiers
| CAS Number | 340812-91-1 |
|---|---|
| SMILES | CCSC1=C(C=CC(=N1)C2=CN=CC=C2)C#N |
Product Overview
6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile (CAS 340812-91-1), with molecular formula C13H11N3S and molecular weight 241.07 g/mol. IUPAC: 2-ethylsulfanyl-6-pyridin-3-ylpyridine-3-carbonitrile.
Chemical Property Profile of 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile
Property Insights of 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile
The XLogP value of 3.12728 indicates that 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.57 Ų, 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Ethylsulfanyl-[2,3']bipyridinyl-5-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 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile?
The CAS number of 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile is 340812-91-1.
What is the molecular formula of 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile?
The molecular formula of 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile is C13H11N3S.
What is the molecular weight of 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile?
The molecular weight of 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile is 241.07 g/mol.
Where can I buy 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile?
You can request a quote for 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Ethylsulfanyl-[2,3']bipyridinyl-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.