1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea
TL;DR: 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea (CAS 891766-18-0) is a chemical compound with molecular formula C13H16ClFN2O2 and molecular weight 286.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea
Also Known As: 1-(3-chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea, 3-(3-chloro-4-fluoro-phenyl)-1-[1-(oxolan-2-yl)ethyl]urea, [(3-chloro-4-fluorophenyl)amino]-N-(oxolan-2-ylethyl)carboxamide, 1-(3-chloro-4-fluorophenyl)-3-[1-(tetrahydrofuran-2-yl)ethyl]urea, N-(3-CHLORO-4-FLUOROPHENYL)-N'-(1-TETRAHYDRO-2-FURANYLETHYL)UREA
| Molecular Formula | C13H16ClFN2O2 |
|---|---|
| Molecular Weight | 286.09 g/mol |
| LogP | 3.1681 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.08844 |
| Heavy Atoms | 19 |
| Complexity | 463.95648 |
Chemical Identifiers
| CAS Number | 891766-18-0 |
|---|---|
| SMILES | CC(C1CCCO1)NC(=O)NC2=CC(=C(C=C2)F)Cl |
Product Overview
1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea (CAS 891766-18-0), with molecular formula C13H16ClFN2O2 and molecular weight 286.09 g/mol. IUPAC: 1-(3-chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea.
Chemical Property Profile of 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea
Property Insights of 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea
The XLogP value of 3.1681 indicates that 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea 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 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea?
The CAS number of 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea is 891766-18-0.
What is the molecular formula of 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea?
The molecular formula of 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea is C13H16ClFN2O2.
What is the molecular weight of 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea?
The molecular weight of 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea is 286.09 g/mol.
Where can I buy 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea?
You can request a quote for 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]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-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.