5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one
TL;DR: 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one (CAS 72975-37-2) is a chemical compound with molecular formula C6H7FN2OS and molecular weight 174.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one
Also Known As: 5-fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one, 5-fluoro-3-methyl-2-(methylthio)pyrimidin-4(3H)-one, 5-fluoro-3-methyl-2-(methylsulfanyl)pyrimidin-4(3H)-one
| Molecular Formula | C6H7FN2OS |
|---|---|
| Molecular Weight | 174.03 g/mol |
| LogP | 0.6413 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.0263 |
| Heavy Atoms | 11 |
| Complexity | 322.8486 |
Chemical Identifiers
| CAS Number | 72975-37-2 |
|---|---|
| SMILES | CN1C(=O)C(=CN=C1SC)F |
Product Overview
5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one (CAS 72975-37-2), with molecular formula C6H7FN2OS and molecular weight 174.03 g/mol. IUPAC: 5-fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one.
Chemical Property Profile of 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one
Property Insights of 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one
The XLogP value of 0.6413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one. With a topological polar surface area (TPSA) of 34.89 Ų, 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one 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 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one?
The CAS number of 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one is 72975-37-2.
What is the molecular formula of 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one?
The molecular formula of 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one is C6H7FN2OS.
What is the molecular weight of 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one?
The molecular weight of 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one is 174.03 g/mol.
Where can I buy 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one?
You can request a quote for 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoro-3-methyl-2-methylsulfanylpyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.