4-Fluorobenzylurea
TL;DR: 4-Fluorobenzylurea (CAS 76523-24-5) is a chemical compound with molecular formula C8H9FN2O and molecular weight 168.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-fluorophenyl)methylurea
Also Known As: 4-FLUOROBENZYLUREA, 1-(4-Fluorobenzyl)urea, 4-Fluorobenzyl urea, N-(4-fluorobenzyl)urea, (4-fluorophenyl)methylurea
| Molecular Formula | C8H9FN2O |
|---|---|
| Molecular Weight | 168.07 g/mol |
| LogP | 0.994 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.06989 |
| Heavy Atoms | 12 |
| Complexity | 270.89127 |
Chemical Identifiers
| CAS Number | 76523-24-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC(=O)N)F |
Product Overview
4-Fluorobenzylurea (CAS 76523-24-5), with molecular formula C8H9FN2O and molecular weight 168.07 g/mol. IUPAC: (4-fluorophenyl)methylurea.
Chemical Property Profile of 4-Fluorobenzylurea
Property Insights of 4-Fluorobenzylurea
The XLogP value of 0.994 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluorobenzylurea. With a topological polar surface area (TPSA) of 55.12 Ų, 4-Fluorobenzylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorobenzylurea has 2 hydrogen bond donor(s) and 1 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-Fluorobenzylurea?
The CAS number of 4-Fluorobenzylurea is 76523-24-5.
What is the molecular formula of 4-Fluorobenzylurea?
The molecular formula of 4-Fluorobenzylurea is C8H9FN2O.
What is the molecular weight of 4-Fluorobenzylurea?
The molecular weight of 4-Fluorobenzylurea is 168.07 g/mol.
Where can I buy 4-Fluorobenzylurea?
You can request a quote for 4-Fluorobenzylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorobenzylurea?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorobenzylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.