N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea
TL;DR: N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea (CAS 978-63-2) is a chemical compound with molecular formula C15H9ClF6N2O and molecular weight 382.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chlorophenyl)urea
Also Known As: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chlorophenyl)urea, n-(3,5-bis(trifluoromethyl)phenyl)-n'-(3-chlorophenyl)urea, N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea, N-[3,5-bis(trifluoromethyl)phenyl][(3-chlorophenyl)amino]carboxamide, GNF-Pf-101
| Molecular Formula | C15H9ClF6N2O |
|---|---|
| Molecular Weight | 382.03 g/mol |
| LogP | 6.0216 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.03076 |
| Heavy Atoms | 25 |
| Complexity | 756.07153 |
Chemical Identifiers
| CAS Number | 978-63-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F |
Product Overview
N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea (CAS 978-63-2), with molecular formula C15H9ClF6N2O and molecular weight 382.03 g/mol. IUPAC: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chlorophenyl)urea.
Chemical Property Profile of N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea
Property Insights of N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea
The XLogP value of 6.0216 indicates that N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea?
The CAS number of N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea is 978-63-2.
What is the molecular formula of N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea?
The molecular formula of N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea is C15H9ClF6N2O.
What is the molecular weight of N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea?
The molecular weight of N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea is 382.03 g/mol.
Where can I buy N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea?
You can request a quote for N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-chlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.