(2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate
TL;DR: (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate (CAS 1090781-03-5) is a chemical compound with molecular formula C16H17NO4S and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dimethoxyphenyl)methyl 2-methylsulfanylpyridine-3-carboxylate
Also Known As: (2,5-dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate
| Molecular Formula | C16H17NO4S |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | 3.1777 |
| Topological Polar Surface Area | 57.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.08783 |
| Heavy Atoms | 22 |
| Complexity | 660.3441 |
Chemical Identifiers
| CAS Number | 1090781-03-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)COC(=O)C2=C(N=CC=C2)SC |
Product Overview
(2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate (CAS 1090781-03-5), with molecular formula C16H17NO4S and molecular weight 319.09 g/mol. IUPAC: (2,5-dimethoxyphenyl)methyl 2-methylsulfanylpyridine-3-carboxylate.
Chemical Property Profile of (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate
Property Insights of (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate
The XLogP value of 3.1777 indicates that (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.65 Ų, (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate has 0 hydrogen bond donor(s) and 6 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 (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate?
The CAS number of (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate is 1090781-03-5.
What is the molecular formula of (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate?
The molecular formula of (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate is C16H17NO4S.
What is the molecular weight of (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate?
The molecular weight of (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate is 319.09 g/mol.
Where can I buy (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate?
You can request a quote for (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (2,5-Dimethoxyphenyl)methyl 2-(methylsulfanyl)pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.