![1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone structure](/static/products/119/119730-22-2.png)
1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone
TL;DR: 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone (CAS 119730-22-2) is a chemical compound with molecular formula C12H9FN2O2S and molecular weight 264.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-1H-pyrimidin-6-one
Also Known As: 2-(4-fluorobenzoylmethylthio)pyrimidin-4(1H)-one, 1-(4-fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone, 2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-1H-pyrimidin-6-one
| Molecular Formula | C12H9FN2O2S |
|---|---|
| Molecular Weight | 264.04 g/mol |
| LogP | 1.884 |
| Topological Polar Surface Area | 62.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.03687 |
| Heavy Atoms | 18 |
| Complexity | 609.9745 |
Chemical Identifiers
| CAS Number | 119730-22-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CSC2=NC=CC(=O)N2)F |
Product Overview
1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone (CAS 119730-22-2), with molecular formula C12H9FN2O2S and molecular weight 264.04 g/mol. IUPAC: 2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-1H-pyrimidin-6-one.
Chemical Property Profile of 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone
Property Insights of 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone
The XLogP value of 1.884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone. The TPSA of 62.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone. Following Lipinski's Rule of Five, 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone 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 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone?
The CAS number of 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone is 119730-22-2.
What is the molecular formula of 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone?
The molecular formula of 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone is C12H9FN2O2S.
What is the molecular weight of 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone?
The molecular weight of 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone is 264.04 g/mol.
Where can I buy 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone?
You can request a quote for 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorophenyl)-2-[(4-hydroxypyrimidin-2-yl)sulfanyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.