1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea
TL;DR: 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea (CAS 293324-63-7) is a chemical compound with molecular formula C17H13Cl4N3O4 and molecular weight 462.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea
Also Known As: 1-(4-chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea, [(4-chlorophenyl)amino]-N-[3-(4-nitrophenyl)-3-oxo-1-(trichloromethyl)propyl]c arboxamide
| Molecular Formula | C17H13Cl4N3O4 |
|---|---|
| Molecular Weight | 462.97 g/mol |
| LogP | 5.3815 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.966 |
| Heavy Atoms | 28 |
| Complexity | 867.4664 |
Chemical Identifiers
| CAS Number | 293324-63-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CC(C(Cl)(Cl)Cl)NC(=O)NC2=CC=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea (CAS 293324-63-7), with molecular formula C17H13Cl4N3O4 and molecular weight 462.97 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea.
Chemical Property Profile of 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea
Property Insights of 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea
The XLogP value of 5.3815 indicates that 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
The CAS number of 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea is 293324-63-7.
What is the molecular formula of 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
The molecular formula of 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea is C17H13Cl4N3O4.
What is the molecular weight of 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
The molecular weight of 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea is 462.97 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
You can request a quote for 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-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-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.