3-Chlorophenylurea
TL;DR: 3-Chlorophenylurea (CAS 1967-27-7) is a chemical compound with molecular formula C7H7ClN2O and molecular weight 170.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chlorophenyl)urea
Also Known As: 3-CHLOROPHENYLUREA, (3-chlorophenyl)urea, m-Chlorophenylurea, 1-(3-chlorophenyl)urea, meta-Chlorophenylurea
| Molecular Formula | C7H7ClN2O |
|---|---|
| Molecular Weight | 170.02 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.02469 |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 1967-27-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)N |
| InChIKey | PPCUBWWPGYHEJE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chlorophenylurea (CAS 1967-27-7), with molecular formula C7H7ClN2O and molecular weight 170.02 g/mol. IUPAC: (3-chlorophenyl)urea.
Chemical Property Profile of 3-Chlorophenylurea
Property Insights of 3-Chlorophenylurea
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chlorophenylurea. With a topological polar surface area (TPSA) of 55.1 Ų, 3-Chlorophenylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chlorophenylurea 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 3-Chlorophenylurea?
The CAS number of 3-Chlorophenylurea is 1967-27-7.
What is the molecular formula of 3-Chlorophenylurea?
The molecular formula of 3-Chlorophenylurea is C7H7ClN2O.
What is the molecular weight of 3-Chlorophenylurea?
The molecular weight of 3-Chlorophenylurea is 170.02 g/mol.
Where can I buy 3-Chlorophenylurea?
You can request a quote for 3-Chlorophenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chlorophenylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-Chlorophenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.