6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine
TL;DR: 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine (CAS 23994-34-5) is a chemical compound with molecular formula C16H20ClN3OS and molecular weight 337.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-5-[(4-ethoxyphenyl)methyl]-N,N-dimethyl-2-methylsulfanylpyrimidin-4-amine
Also Known As: BAS 01579195, 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine, [6-Chloro-5-(4-ethoxy-benzyl)-2-methylsulfanyl-pyrimidin-4-yl]-dimethyl-amine, 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylthio)pyrimidin-4-amine, {6-chloro-5-[(4-ethoxyphenyl)methyl]-2-methylthiopyrimidin-4-yl}dimethylamine
| Molecular Formula | C16H20ClN3OS |
|---|---|
| Molecular Weight | 337.10 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 337.10156 |
| Heavy Atoms | 22 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 23994-34-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)N(C)C |
| InChIKey | FHMLOVJXXSHWDS-UHFFFAOYSA-N |
Product Overview
6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine (CAS 23994-34-5), with molecular formula C16H20ClN3OS and molecular weight 337.10 g/mol. IUPAC: 6-chloro-5-[(4-ethoxyphenyl)methyl]-N,N-dimethyl-2-methylsulfanylpyrimidin-4-amine.
Chemical Property Profile of 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine
Property Insights of 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine
The XLogP value of 4.7 indicates that 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine. Following Lipinski's Rule of Five, 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine 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 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine?
The CAS number of 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine is 23994-34-5.
What is the molecular formula of 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine?
The molecular formula of 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine is C16H20ClN3OS.
What is the molecular weight of 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine?
The molecular weight of 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine is 337.10 g/mol.
Where can I buy 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine?
You can request a quote for 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-5-(4-ethoxybenzyl)-N,N-dimethyl-2-(methylsulfanyl)pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.