4-(2-(Cyclohexylthio)ethyl)pyridine oxalate
TL;DR: 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate (CAS 304013-27-2) is a chemical compound with molecular formula C15H21NO4S and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-cyclohexylsulfanylethyl)pyridine;oxalic acid
Also Known As: 4-(2-(cyclohexylthio)ethyl)pyridine oxalate, 4-[2-(Cyclohexylthio)ethyl]pyridine oxalate, 4-(2-cyclohexylsulfanylethyl)pyridine; oxalic acid, 4-(2-cyclohexylsulfanylethyl)pyridine;oxalic acid, IUPAC: 4-(2-cyclohexylsulfanylethyl)pyridine; Oxalic Acid
| Molecular Formula | C15H21NO4S |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 2.8456 |
| Topological Polar Surface Area | 87.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.11914 |
| Heavy Atoms | 21 |
| Complexity | 420.55957 |
Chemical Identifiers
| CAS Number | 304013-27-2 |
|---|---|
| SMILES | C1CCC(CC1)SCCC2=CC=NC=C2.C(=O)(C(=O)O)O |
Product Overview
4-(2-(Cyclohexylthio)ethyl)pyridine oxalate (CAS 304013-27-2), with molecular formula C15H21NO4S and molecular weight 311.12 g/mol. IUPAC: 4-(2-cyclohexylsulfanylethyl)pyridine;oxalic acid.
Chemical Property Profile of 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate
Property Insights of 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate
The XLogP value of 2.8456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate. The TPSA of 87.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate. Following Lipinski's Rule of Five, 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate has 2 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 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate?
The CAS number of 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate is 304013-27-2.
What is the molecular formula of 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate?
The molecular formula of 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate is C15H21NO4S.
What is the molecular weight of 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate?
The molecular weight of 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate is 311.12 g/mol.
Where can I buy 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate?
You can request a quote for 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-(Cyclohexylthio)ethyl)pyridine oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.