2-(4-Fluorophenyl)-4(3H)-pyrimidinone
TL;DR: 2-(4-Fluorophenyl)-4(3H)-pyrimidinone (CAS 76128-79-5) is a chemical compound with molecular formula C10H7FN2O and molecular weight 190.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-1H-pyrimidin-6-one
Also Known As: 2-(4-Fluorophenyl)-4(3H)-pyrimidinone, 2-(4-Fluorophenyl)pyrimidin-4(3H)-one, 4-Hydroxy-2-(4-fluorophenyl)pyrimidine, 4(3H)-Pyrimidinone, 2-(4-fluorophenyl)-, 4-hydroxy-2-(p-fluorophenyl)pyrimidine
| Molecular Formula | C10H7FN2O |
|---|---|
| Molecular Weight | 190.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.05424 |
| Heavy Atoms | 14 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 76128-79-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC=CC(=O)N2)F |
| InChIKey | SLVBPLUHJQMEAO-UHFFFAOYSA-N |
Product Overview
2-(4-Fluorophenyl)-4(3H)-pyrimidinone (CAS 76128-79-5), with molecular formula C10H7FN2O and molecular weight 190.05 g/mol. IUPAC: 2-(4-fluorophenyl)-1H-pyrimidin-6-one.
Chemical Property Profile of 2-(4-Fluorophenyl)-4(3H)-pyrimidinone
Property Insights of 2-(4-Fluorophenyl)-4(3H)-pyrimidinone
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Fluorophenyl)-4(3H)-pyrimidinone. With a topological polar surface area (TPSA) of 41.5 Ų, 2-(4-Fluorophenyl)-4(3H)-pyrimidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Fluorophenyl)-4(3H)-pyrimidinone has 1 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 2-(4-Fluorophenyl)-4(3H)-pyrimidinone?
The CAS number of 2-(4-Fluorophenyl)-4(3H)-pyrimidinone is 76128-79-5.
What is the molecular formula of 2-(4-Fluorophenyl)-4(3H)-pyrimidinone?
The molecular formula of 2-(4-Fluorophenyl)-4(3H)-pyrimidinone is C10H7FN2O.
What is the molecular weight of 2-(4-Fluorophenyl)-4(3H)-pyrimidinone?
The molecular weight of 2-(4-Fluorophenyl)-4(3H)-pyrimidinone is 190.05 g/mol.
Where can I buy 2-(4-Fluorophenyl)-4(3H)-pyrimidinone?
You can request a quote for 2-(4-Fluorophenyl)-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 2-(4-Fluorophenyl)-4(3H)-pyrimidinone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluorophenyl)-4(3H)-pyrimidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.