N-(3-chlorophenyl)-N'-methylurea
TL;DR: N-(3-chlorophenyl)-N'-methylurea (CAS 20940-42-5) is a chemical compound with molecular formula C8H9ClN2O and molecular weight 184.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-3-methylurea
Also Known As: 1-(3-chlorophenyl)-3-methylurea, 3-chlorobenzylurea, N-(3-CHLOROPHENYL)-N'-METHYLUREA, N-Methyl-N'-(3-chlorophenyl)urea, 3-(3,4-chlorophenyl)-1-methylurea
| Molecular Formula | C8H9ClN2O |
|---|---|
| Molecular Weight | 184.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.04034 |
| Heavy Atoms | 12 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 20940-42-5 |
|---|---|
| SMILES | CNC(=O)NC1=CC(=CC=C1)Cl |
| InChIKey | MIRQKFUBAFNLEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(3-chlorophenyl)-N'-methylurea (CAS 20940-42-5), with molecular formula C8H9ClN2O and molecular weight 184.04 g/mol. IUPAC: 1-(3-chlorophenyl)-3-methylurea.
Chemical Property Profile of N-(3-chlorophenyl)-N'-methylurea
Property Insights of N-(3-chlorophenyl)-N'-methylurea
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chlorophenyl)-N'-methylurea. With a topological polar surface area (TPSA) of 41.1 Ų, N-(3-chlorophenyl)-N'-methylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-N'-methylurea 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-chlorophenyl)-N'-methylurea?
The CAS number of N-(3-chlorophenyl)-N'-methylurea is 20940-42-5.
What is the molecular formula of N-(3-chlorophenyl)-N'-methylurea?
The molecular formula of N-(3-chlorophenyl)-N'-methylurea is C8H9ClN2O.
What is the molecular weight of N-(3-chlorophenyl)-N'-methylurea?
The molecular weight of N-(3-chlorophenyl)-N'-methylurea is 184.04 g/mol.
Where can I buy N-(3-chlorophenyl)-N'-methylurea?
You can request a quote for N-(3-chlorophenyl)-N'-methylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chlorophenyl)-N'-methylurea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chlorophenyl)-N'-methylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.