1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea
TL;DR: 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea (CAS 372974-07-7) is a chemical compound with molecular formula C17H12ClF7N2O2 and molecular weight 444.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chlorophenyl)methyl]-3-[1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl]urea
Also Known As: 1-(2-chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea, 1-(2-chlorobenzyl)-3-[1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl]urea, 1-[(2-chlorophenyl)methyl]-3-[1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl]urea, 3-[(2-chlorophenyl)methyl]-1-[1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl]urea
| Molecular Formula | C17H12ClF7N2O2 |
|---|---|
| Molecular Weight | 444.05 g/mol |
| LogP | 5.1782 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.04755 |
| Heavy Atoms | 29 |
| Complexity | 840.0953 |
Chemical Identifiers
| CAS Number | 372974-07-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CNC(=O)NC(C(F)(F)F)(C(F)(F)F)OC2=CC=C(C=C2)F)Cl |
Product Overview
1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea (CAS 372974-07-7), with molecular formula C17H12ClF7N2O2 and molecular weight 444.05 g/mol. IUPAC: 1-[(2-chlorophenyl)methyl]-3-[1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl]urea.
Chemical Property Profile of 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea
Property Insights of 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea
The XLogP value of 5.1782 indicates that 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)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-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea?
The CAS number of 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea is 372974-07-7.
What is the molecular formula of 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea?
The molecular formula of 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea is C17H12ClF7N2O2.
What is the molecular weight of 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea?
The molecular weight of 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea is 444.05 g/mol.
Where can I buy 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea?
You can request a quote for 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chlorobenzyl)-3-(1,1,1,3,3,3-hexafluoro-2-(4-fluorophenoxy)propan-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.