4,6-Dichloro-2-(methylthio)pyrimidine
TL;DR: 4,6-Dichloro-2-(methylthio)pyrimidine (CAS 6299-25-8) is a chemical compound with molecular formula C5H4Cl2N2S and molecular weight 193.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-2-methylsulfanylpyrimidine
Also Known As: 4,6-Dichloro-2-(methylthio)pyrimidine, null, phenylbiguanide, 4,6-Dichloro-2-methylmercaptopyrimidine, 6-Quinoxalinamine
| Molecular Formula | C5H4Cl2N2S |
|---|---|
| Molecular Weight | 193.95 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.94722 |
| Heavy Atoms | 10 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 6299-25-8 |
|---|---|
| SMILES | CSC1=NC(=CC(=N1)Cl)Cl |
| InChIKey | FCMLONIWOAGZJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6-Dichloro-2-(methylthio)pyrimidine (CAS 6299-25-8), with molecular formula C5H4Cl2N2S and molecular weight 193.95 g/mol. IUPAC: 4,6-dichloro-2-methylsulfanylpyrimidine.
Chemical Property Profile of 4,6-Dichloro-2-(methylthio)pyrimidine
Property Insights of 4,6-Dichloro-2-(methylthio)pyrimidine
The XLogP value of 3.0 indicates that 4,6-Dichloro-2-(methylthio)pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.1 Ų, 4,6-Dichloro-2-(methylthio)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dichloro-2-(methylthio)pyrimidine has 0 hydrogen bond donor(s) and 3 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 4,6-Dichloro-2-(methylthio)pyrimidine?
The CAS number of 4,6-Dichloro-2-(methylthio)pyrimidine is 6299-25-8.
What is the molecular formula of 4,6-Dichloro-2-(methylthio)pyrimidine?
The molecular formula of 4,6-Dichloro-2-(methylthio)pyrimidine is C5H4Cl2N2S.
What is the molecular weight of 4,6-Dichloro-2-(methylthio)pyrimidine?
The molecular weight of 4,6-Dichloro-2-(methylthio)pyrimidine is 193.95 g/mol.
Where can I buy 4,6-Dichloro-2-(methylthio)pyrimidine?
You can request a quote for 4,6-Dichloro-2-(methylthio)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dichloro-2-(methylthio)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dichloro-2-(methylthio)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.