N-(4-bromo-2-fluorophenyl)-N'-phenylurea
TL;DR: N-(4-bromo-2-fluorophenyl)-N'-phenylurea (CAS 540803-47-2) is a chemical compound with molecular formula C13H10BrFN2O and molecular weight 308.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromo-2-fluorophenyl)-3-phenylurea
Also Known As: 1-(4-bromo-2-fluorophenyl)-3-phenylurea, N-(4-bromo-2-fluorophenyl)-N'-phenylurea, 3-(4-bromo-2-fluorophenyl)-1-phenylurea, Urea, N-(4-bromo-2-fluorophenyl)-N'-phenyl-, [(4-bromo-2-fluorophenyl)amino]-N-benzamide
| Molecular Formula | C13H10BrFN2O |
|---|---|
| Molecular Weight | 308.00 g/mol |
| LogP | 4.2322 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.99606 |
| Heavy Atoms | 18 |
| Complexity | 560.1726 |
Chemical Identifiers
| CAS Number | 540803-47-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Br)F |
Product Overview
N-(4-bromo-2-fluorophenyl)-N'-phenylurea (CAS 540803-47-2), with molecular formula C13H10BrFN2O and molecular weight 308.00 g/mol. IUPAC: 1-(4-bromo-2-fluorophenyl)-3-phenylurea.
Chemical Property Profile of N-(4-bromo-2-fluorophenyl)-N'-phenylurea
Property Insights of N-(4-bromo-2-fluorophenyl)-N'-phenylurea
The XLogP value of 4.2322 indicates that N-(4-bromo-2-fluorophenyl)-N'-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(4-bromo-2-fluorophenyl)-N'-phenylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromo-2-fluorophenyl)-N'-phenylurea 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 N-(4-bromo-2-fluorophenyl)-N'-phenylurea?
The CAS number of N-(4-bromo-2-fluorophenyl)-N'-phenylurea is 540803-47-2.
What is the molecular formula of N-(4-bromo-2-fluorophenyl)-N'-phenylurea?
The molecular formula of N-(4-bromo-2-fluorophenyl)-N'-phenylurea is C13H10BrFN2O.
What is the molecular weight of N-(4-bromo-2-fluorophenyl)-N'-phenylurea?
The molecular weight of N-(4-bromo-2-fluorophenyl)-N'-phenylurea is 308.00 g/mol.
Where can I buy N-(4-bromo-2-fluorophenyl)-N'-phenylurea?
You can request a quote for N-(4-bromo-2-fluorophenyl)-N'-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromo-2-fluorophenyl)-N'-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromo-2-fluorophenyl)-N'-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.