N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea
TL;DR: N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea (CAS 221116-85-4) is a chemical compound with molecular formula C14H12Cl2N2O and molecular weight 294.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-methylphenyl)-3-(4-chlorophenyl)urea
Also Known As: N-(3-chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea, 1-(3-chloro-4-methylphenyl)-3-(4-chlorophenyl)urea, J1.063.038J, 3-(3-chloro-4-methylphenyl)-1-(4-chlorophenyl)urea, 1-(4-Chlorophenyl)-3-(3-chloro-4-methylphenyl)urea
| Molecular Formula | C14H12Cl2N2O |
|---|---|
| Molecular Weight | 294.03 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.03265 |
| Heavy Atoms | 19 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 221116-85-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)Cl)Cl |
| InChIKey | XULHYDFFHVARJN-UHFFFAOYSA-N |
Product Overview
N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea (CAS 221116-85-4), with molecular formula C14H12Cl2N2O and molecular weight 294.03 g/mol. IUPAC: 1-(3-chloro-4-methylphenyl)-3-(4-chlorophenyl)urea.
Chemical Property Profile of N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea
Property Insights of N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea
The XLogP value of 4.7 indicates that N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea 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-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea?
The CAS number of N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea is 221116-85-4.
What is the molecular formula of N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea?
The molecular formula of N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea is C14H12Cl2N2O.
What is the molecular weight of N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea?
The molecular weight of N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea is 294.03 g/mol.
Where can I buy N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea?
You can request a quote for N-(3-Chloro-4-methylphenyl)-N'-(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 N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Chloro-4-methylphenyl)-N'-(4-chlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.