4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine
TL;DR: 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine (CAS 23994-35-6) is a chemical compound with molecular formula C19H24ClN3OS and molecular weight 377.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-5-[(4-ethoxyphenyl)methyl]-2-methylsulfanyl-6-piperidin-1-ylpyrimidine
Also Known As: BAS 01579197, 4-Chloro-5-(4-ethoxy-benzyl)-2-methylsulfanyl-6-piperidin-1-yl-pyrimidine, 4-chloro-5-(4-ethoxybenzyl)-2-(methylthio)-6-(piperidin-1-yl)pyrimidine, 4-chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine, 4-chloro-5-[(4-ethoxyphenyl)methyl]-2-methylsulfanyl-6-piperidin-1-ylpyrimidine
| Molecular Formula | C19H24ClN3OS |
|---|---|
| Molecular Weight | 377.13 g/mol |
| LogP | 4.8317 |
| Topological Polar Surface Area | 38.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.13287 |
| Heavy Atoms | 25 |
| Complexity | 702.56055 |
Chemical Identifiers
| CAS Number | 23994-35-6 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)N3CCCCC3 |
Product Overview
4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine (CAS 23994-35-6), with molecular formula C19H24ClN3OS and molecular weight 377.13 g/mol. IUPAC: 4-chloro-5-[(4-ethoxyphenyl)methyl]-2-methylsulfanyl-6-piperidin-1-ylpyrimidine.
Chemical Property Profile of 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine
Property Insights of 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine
The XLogP value of 4.8317 indicates that 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.25 Ų, 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine has 0 hydrogen bond donor(s) and 5 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-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine?
The CAS number of 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine is 23994-35-6.
What is the molecular formula of 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine?
The molecular formula of 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine is C19H24ClN3OS.
What is the molecular weight of 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine?
The molecular weight of 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine is 377.13 g/mol.
Where can I buy 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine?
You can request a quote for 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-5-(4-ethoxybenzyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.