5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone
TL;DR: 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone (CAS 1480-92-8) is a chemical compound with molecular formula C5H5FN2OS and molecular weight 160.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-2-methylsulfanyl-1H-pyrimidin-6-one
Also Known As: 5-Fluoro-2-(methylthio)pyrimidin-4-ol, 5-fluoro-2-methylsulfanyl-1H-pyrimidin-6-one, 5-Fluoro-2-methylsulfanyl-pyrimidin-4-ol, 5-FLUORO-4-HYDROXY-2-METHYL-SULFANYLPYRIMIDINE, 5-FLUORO-2-(METHYLSULFANYL)PYRIMIDIN-4-OL
| Molecular Formula | C5H5FN2OS |
|---|---|
| Molecular Weight | 160.01 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.01067 |
| Heavy Atoms | 10 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 1480-92-8 |
|---|---|
| SMILES | CSC1=NC=C(C(=O)N1)F |
| InChIKey | VSCLCCQOVQNZLO-UHFFFAOYSA-N |
Product Overview
5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone (CAS 1480-92-8), with molecular formula C5H5FN2OS and molecular weight 160.01 g/mol. IUPAC: 5-fluoro-2-methylsulfanyl-1H-pyrimidin-6-one.
Chemical Property Profile of 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone
Property Insights of 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone. Following Lipinski's Rule of Five, 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone has 1 hydrogen bond donor(s) and 4 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-2-(methylthio)-4(3H)-pyrimidinone?
The CAS number of 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone is 1480-92-8.
What is the molecular formula of 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone?
The molecular formula of 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone is C5H5FN2OS.
What is the molecular weight of 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone?
The molecular weight of 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone is 160.01 g/mol.
Where can I buy 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone?
You can request a quote for 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoro-2-(methylthio)-4(3H)-pyrimidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.