Urea, 1-(p-fluorophenyl)-3-methyl-
TL;DR: Urea, 1-(p-fluorophenyl)-3-methyl- (CAS 772-55-4) is a chemical compound with molecular formula C8H9FN2O and molecular weight 168.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-3-methylurea
Also Known As: 1-(4-fluorophenyl)-3-methylurea, 1-methyl-3- urea, Urea, 1-(p-fluorophenyl)-3-methyl-, 1-(p-Fluorophenyl)-3-methylurea, N-(4-Fluorophenyl)-N'-methylurea
| Molecular Formula | C8H9FN2O |
|---|---|
| Molecular Weight | 168.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.06989 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 772-55-4 |
|---|---|
| SMILES | CNC(=O)NC1=CC=C(C=C1)F |
| InChIKey | MGVNYJAWTVSWFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Urea, 1-(p-fluorophenyl)-3-methyl- (CAS 772-55-4), with molecular formula C8H9FN2O and molecular weight 168.07 g/mol. IUPAC: 1-(4-fluorophenyl)-3-methylurea.
Chemical Property Profile of Urea, 1-(p-fluorophenyl)-3-methyl-
Property Insights of Urea, 1-(p-fluorophenyl)-3-methyl-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(p-fluorophenyl)-3-methyl-. With a topological polar surface area (TPSA) of 41.1 Ų, Urea, 1-(p-fluorophenyl)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-(p-fluorophenyl)-3-methyl- has 2 hydrogen bond donor(s) and 2 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 Urea, 1-(p-fluorophenyl)-3-methyl-?
The CAS number of Urea, 1-(p-fluorophenyl)-3-methyl- is 772-55-4.
What is the molecular formula of Urea, 1-(p-fluorophenyl)-3-methyl-?
The molecular formula of Urea, 1-(p-fluorophenyl)-3-methyl- is C8H9FN2O.
What is the molecular weight of Urea, 1-(p-fluorophenyl)-3-methyl-?
The molecular weight of Urea, 1-(p-fluorophenyl)-3-methyl- is 168.07 g/mol.
Where can I buy Urea, 1-(p-fluorophenyl)-3-methyl-?
You can request a quote for Urea, 1-(p-fluorophenyl)-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(p-fluorophenyl)-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(p-fluorophenyl)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.