1-(3-Chloro-para-tolyl)-urea
TL;DR: 1-(3-Chloro-para-tolyl)-urea (CAS 13142-64-8) 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.
(3-chloro-4-methylphenyl)urea
Also Known As: 1-(3-chloro-4-methylphenyl)urea, 3-chloro-4-methylphenylurea, (3-CHLORO-4-METHYLPHENYL)UREA, N-(3-chloro-4-methylphenyl)urea, 1- UREA
| Molecular Formula | C8H9ClN2O |
|---|---|
| Molecular Weight | 184.04 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.04034 |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 13142-64-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)N)Cl |
| InChIKey | GAFWRUXZGSUTHS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3-Chloro-para-tolyl)-urea (CAS 13142-64-8), with molecular formula C8H9ClN2O and molecular weight 184.04 g/mol. IUPAC: (3-chloro-4-methylphenyl)urea.
Chemical Property Profile of 1-(3-Chloro-para-tolyl)-urea
Property Insights of 1-(3-Chloro-para-tolyl)-urea
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chloro-para-tolyl)-urea. With a topological polar surface area (TPSA) of 55.1 Ų, 1-(3-Chloro-para-tolyl)-urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-para-tolyl)-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 1-(3-Chloro-para-tolyl)-urea?
The CAS number of 1-(3-Chloro-para-tolyl)-urea is 13142-64-8.
What is the molecular formula of 1-(3-Chloro-para-tolyl)-urea?
The molecular formula of 1-(3-Chloro-para-tolyl)-urea is C8H9ClN2O.
What is the molecular weight of 1-(3-Chloro-para-tolyl)-urea?
The molecular weight of 1-(3-Chloro-para-tolyl)-urea is 184.04 g/mol.
Where can I buy 1-(3-Chloro-para-tolyl)-urea?
You can request a quote for 1-(3-Chloro-para-tolyl)-urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chloro-para-tolyl)-urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-para-tolyl)-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.