1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea
TL;DR: 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea (CAS 445008-79-7) is a chemical compound with molecular formula C14H12BrClN2O and molecular weight 337.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromo-3-methylphenyl)-3-(4-chlorophenyl)urea
Also Known As: 1-(4-bromo-3-methylphenyl)-3-(4-chlorophenyl)urea, N-(4-bromo-3-methylphenyl)-N'-(4-chlorophenyl)urea, [(4-bromo-3-methylphenyl)amino]-N-(4-chlorophenyl)carboxamide
| Molecular Formula | C14H12BrClN2O |
|---|---|
| Molecular Weight | 337.98 g/mol |
| LogP | 5.05492 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.98215 |
| Heavy Atoms | 19 |
| Complexity | 598.895 |
Chemical Identifiers
| CAS Number | 445008-79-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)Cl)Br |
Product Overview
1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea (CAS 445008-79-7), with molecular formula C14H12BrClN2O and molecular weight 337.98 g/mol. IUPAC: 1-(4-bromo-3-methylphenyl)-3-(4-chlorophenyl)urea.
Chemical Property Profile of 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea
Property Insights of 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea
The XLogP value of 5.05492 indicates that 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea?
The CAS number of 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea is 445008-79-7.
What is the molecular formula of 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea?
The molecular formula of 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea is C14H12BrClN2O.
What is the molecular weight of 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea?
The molecular weight of 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea is 337.98 g/mol.
Where can I buy 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea?
You can request a quote for 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromo-3-methylphenyl)-3-(4-chlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.