1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea
TL;DR: 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea (CAS 317335-88-9) is a chemical compound with molecular formula C17H13Cl5N2O2 and molecular weight 451.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea
Also Known As: 1-phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea, AE-848/32734027, 1-phenyl-3-(1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl)urea, N-[3-(2,4-dichlorophenyl)-3-oxo-1-(trichloromethyl)propyl]-N'-phenylurea
| Molecular Formula | C17H13Cl5N2O2 |
|---|---|
| Molecular Weight | 451.94 g/mol |
| LogP | 6.1267 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 451.94196 |
| Heavy Atoms | 26 |
| Complexity | 793.4854 |
Chemical Identifiers
| CAS Number | 317335-88-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC(CC(=O)C2=C(C=C(C=C2)Cl)Cl)C(Cl)(Cl)Cl |
Product Overview
1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea (CAS 317335-88-9), with molecular formula C17H13Cl5N2O2 and molecular weight 451.94 g/mol. IUPAC: 1-phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea.
Chemical Property Profile of 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea
Property Insights of 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea
The XLogP value of 6.1267 indicates that 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-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-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea?
The CAS number of 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea is 317335-88-9.
What is the molecular formula of 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea?
The molecular formula of 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea is C17H13Cl5N2O2.
What is the molecular weight of 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea?
The molecular weight of 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea is 451.94 g/mol.
Where can I buy 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea?
You can request a quote for 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-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-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-[1,1,1-trichloro-4-(2,4-dichlorophenyl)-4-oxobutan-2-yl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.