2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile
TL;DR: 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile (CAS 312757-97-4) is a chemical compound with molecular formula C22H20N2O2S and molecular weight 376.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile
Also Known As: 2-(ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile, AE-848/34405010, 2-ethylsulfanyl-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile, 2-(ethylsulfanyl)-4,6-bis(4-methoxyphenyl)nicotinonitrile, 2-(ethylsulfanyl)-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile
| Molecular Formula | C22H20N2O2S |
|---|---|
| Molecular Weight | 376.12 g/mol |
| LogP | 5.41648 |
| Topological Polar Surface Area | 55.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.12454 |
| Heavy Atoms | 27 |
| Complexity | 961.3432 |
Chemical Identifiers
| CAS Number | 312757-97-4 |
|---|---|
| SMILES | CCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C#N |
Product Overview
2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile (CAS 312757-97-4), with molecular formula C22H20N2O2S and molecular weight 376.12 g/mol. IUPAC: 2-ethylsulfanyl-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile.
Chemical Property Profile of 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile
Property Insights of 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile
The XLogP value of 5.41648 indicates that 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.14 Ų, 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile?
The CAS number of 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile is 312757-97-4.
What is the molecular formula of 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile?
The molecular formula of 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile is C22H20N2O2S.
What is the molecular weight of 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile?
The molecular weight of 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile is 376.12 g/mol.
Where can I buy 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile?
You can request a quote for 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Ethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.