4-Chloro-2-(4-fluorophenyl)pyrimidine
TL;DR: 4-Chloro-2-(4-fluorophenyl)pyrimidine (CAS 76128-71-7) is a chemical compound with molecular formula C10H6ClFN2 and molecular weight 208.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-(4-fluorophenyl)pyrimidine
Also Known As: 4-Chloro-2-(4-fluorophenyl)pyrimidine, starbld0013059, 4-chloro-2-(p-fluorophenyl)pyrimidine, Pyrimidine, 4-chloro-2-(4-fluorophenyl)-, RefChem:98341
| Molecular Formula | C10H6ClFN2 |
|---|---|
| Molecular Weight | 208.02 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.02036 |
| Heavy Atoms | 14 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 76128-71-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC=CC(=N2)Cl)F |
| InChIKey | UPHJPEPWOCWYDB-UHFFFAOYSA-N |
Product Overview
4-Chloro-2-(4-fluorophenyl)pyrimidine (CAS 76128-71-7), with molecular formula C10H6ClFN2 and molecular weight 208.02 g/mol. IUPAC: 4-chloro-2-(4-fluorophenyl)pyrimidine.
Chemical Property Profile of 4-Chloro-2-(4-fluorophenyl)pyrimidine
Property Insights of 4-Chloro-2-(4-fluorophenyl)pyrimidine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2-(4-fluorophenyl)pyrimidine. With a topological polar surface area (TPSA) of 25.8 Ų, 4-Chloro-2-(4-fluorophenyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-(4-fluorophenyl)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-Chloro-2-(4-fluorophenyl)pyrimidine?
The CAS number of 4-Chloro-2-(4-fluorophenyl)pyrimidine is 76128-71-7.
What is the molecular formula of 4-Chloro-2-(4-fluorophenyl)pyrimidine?
The molecular formula of 4-Chloro-2-(4-fluorophenyl)pyrimidine is C10H6ClFN2.
What is the molecular weight of 4-Chloro-2-(4-fluorophenyl)pyrimidine?
The molecular weight of 4-Chloro-2-(4-fluorophenyl)pyrimidine is 208.02 g/mol.
Where can I buy 4-Chloro-2-(4-fluorophenyl)pyrimidine?
You can request a quote for 4-Chloro-2-(4-fluorophenyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-(4-fluorophenyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-(4-fluorophenyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.