N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea
TL;DR: N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea (CAS 66448-30-4) is a chemical compound with molecular formula C13H12FN3O and molecular weight 245.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-3-(pyridin-4-ylmethyl)urea
Also Known As: N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea, 1-(4-fluorophenyl)-3-(pyridin-4-ylmethyl)urea, US11452717, Compound TableB-2.1, AI-204/31696007, N-(4-fluorophenyl)[(4-pyridylmethyl)amino]carboxamide
| Molecular Formula | C13H12FN3O |
|---|---|
| Molecular Weight | 245.10 g/mol |
| LogP | 2.5424 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.09644 |
| Heavy Atoms | 18 |
| Complexity | 513.5194 |
Chemical Identifiers
| CAS Number | 66448-30-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NCC2=CC=NC=C2)F |
Product Overview
N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea (CAS 66448-30-4), with molecular formula C13H12FN3O and molecular weight 245.10 g/mol. IUPAC: 1-(4-fluorophenyl)-3-(pyridin-4-ylmethyl)urea.
Chemical Property Profile of N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea
Property Insights of N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea
The XLogP value of 2.5424 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea. With a topological polar surface area (TPSA) of 54.02 Ų, N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea has 2 hydrogen bond donor(s) and 2 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 N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea?
The CAS number of N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea is 66448-30-4.
What is the molecular formula of N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea?
The molecular formula of N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea is C13H12FN3O.
What is the molecular weight of N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea?
The molecular weight of N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea is 245.10 g/mol.
Where can I buy N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea?
You can request a quote for N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorophenyl)-N'-(4-pyridinylmethyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.