piperazinyl)methane-1-thione structure](/static/products/4948/494825-80-8.webp)
[(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione
TL;DR: [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione (CAS 494825-80-8) is a chemical compound with molecular formula C18H22N4OS and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide
Also Known As: BAS 05626321, SDCCGSBI-0660360.P001, AF-399/41178783, [(4-ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione, N-(4-ethoxyphenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide
| Molecular Formula | C18H22N4OS |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 2.9993 |
| Topological Polar Surface Area | 40.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.15143 |
| Heavy Atoms | 24 |
| Complexity | 654.4788 |
Chemical Identifiers
| CAS Number | 494825-80-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=CC=N3 |
Product Overview
[(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione (CAS 494825-80-8), with molecular formula C18H22N4OS and molecular weight 342.15 g/mol. IUPAC: N-(4-ethoxyphenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide.
Chemical Property Profile of [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione
Property Insights of [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione
The XLogP value of 2.9993 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione. With a topological polar surface area (TPSA) of 40.63 Ų, [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione has 1 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-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione?
The CAS number of [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione is 494825-80-8.
What is the molecular formula of [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione?
The molecular formula of [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione is C18H22N4OS.
What is the molecular weight of [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione?
The molecular weight of [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione is 342.15 g/mol.
Where can I buy [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione?
You can request a quote for [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione?
Yes, KEHONG BIO provides custom synthesis services for [(4-Ethoxyphenyl)amino](4-(2-pyridyl)piperazinyl)methane-1-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.