![6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine structure](/static/products/166/166751-66-2.png)
6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine
TL;DR: 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine (CAS 166751-66-2) is a chemical compound with molecular formula C12H12ClN3OS and molecular weight 281.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine
Also Known As: Pyrimidine analog, 6-chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine, 6-chloro-2-[(3-methoxybenzyl)sulfanyl]pyrimidin-4-amine, 4-amino-6-chloro-2-(3-methoxyphenylmethylthio)-pyrimidine, 6-Chloro-2-(3-methoxy-benzylsulfanyl)-pyrimidin-4-ylamine
| Molecular Formula | C12H12ClN3OS |
|---|---|
| Molecular Weight | 281.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.03897 |
| Heavy Atoms | 18 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 166751-66-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CSC2=NC(=CC(=N2)Cl)N |
| InChIKey | UNDHAVDDZLESST-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine (CAS 166751-66-2), with molecular formula C12H12ClN3OS and molecular weight 281.04 g/mol. IUPAC: 6-chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine.
Chemical Property Profile of 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine
Property Insights of 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine
The XLogP value of 3.1 indicates that 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine. Following Lipinski's Rule of Five, 6-Chloro-2-[(3-methoxyphenyl)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-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine?
The CAS number of 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine is 166751-66-2.
What is the molecular formula of 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine?
The molecular formula of 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine is C12H12ClN3OS.
What is the molecular weight of 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine?
The molecular weight of 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine is 281.04 g/mol.
Where can I buy 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine?
You can request a quote for 6-Chloro-2-[(3-methoxyphenyl)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-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.