6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine
TL;DR: 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine (CAS 23994-53-8) is a chemical compound with molecular formula C13H14ClN3OS and molecular weight 295.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-5-[(4-methoxyphenyl)methyl]-2-methylsulfanylpyrimidin-4-amine
Also Known As: 6-chloro-5-(4-methoxybenzyl)-2-(methylthio)pyrimidin-4-amine, 6-chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)-4-pyrimidinylamine, 6-chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine, 6-chloro-5-[(4-methoxyphenyl)methyl]-2-methylsulfanylpyrimidin-4-amine
| Molecular Formula | C13H14ClN3OS |
|---|---|
| Molecular Weight | 295.05 g/mol |
| LogP | 3.0335 |
| Topological Polar Surface Area | 61.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.0546 |
| Heavy Atoms | 19 |
| Complexity | 551.5962 |
Chemical Identifiers
| CAS Number | 23994-53-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)N |
Product Overview
6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine (CAS 23994-53-8), with molecular formula C13H14ClN3OS and molecular weight 295.05 g/mol. IUPAC: 6-chloro-5-[(4-methoxyphenyl)methyl]-2-methylsulfanylpyrimidin-4-amine.
Chemical Property Profile of 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine
Property Insights of 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine
The XLogP value of 3.0335 indicates that 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine. Following Lipinski's Rule of Five, 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine has 1 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-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine?
The CAS number of 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine is 23994-53-8.
What is the molecular formula of 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine?
The molecular formula of 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine is C13H14ClN3OS.
What is the molecular weight of 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine?
The molecular weight of 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine is 295.05 g/mol.
Where can I buy 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine?
You can request a quote for 6-Chloro-5-(4-methoxybenzyl)-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-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-5-(4-methoxybenzyl)-2-(methylsulfanyl)pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.