![1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea structure](/static/products/372/372087-70-2.png)
1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea
TL;DR: 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea (CAS 372087-70-2) is a chemical compound with molecular formula C17H12Cl5N3O4 and molecular weight 496.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea
Also Known As: 1-(2,4-dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea, 1-(2,4-dichlorophenyl)-3-(1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl)urea, 3-(2,4-dichlorophenyl)-1-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxo-butan-2-yl]urea
| Molecular Formula | C17H12Cl5N3O4 |
|---|---|
| Molecular Weight | 496.93 g/mol |
| LogP | 6.0349 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.92703 |
| Heavy Atoms | 29 |
| Complexity | 931.6559 |
Chemical Identifiers
| CAS Number | 372087-70-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CC(C(Cl)(Cl)Cl)NC(=O)NC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-] |
Product Overview
1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea (CAS 372087-70-2), with molecular formula C17H12Cl5N3O4 and molecular weight 496.93 g/mol. IUPAC: 1-(2,4-dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea.
Chemical Property Profile of 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea
Property Insights of 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea
The XLogP value of 6.0349 indicates that 1-(2,4-Dichlorophenyl)-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-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea. Following Lipinski's Rule of Five, 1-(2,4-Dichlorophenyl)-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-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
The CAS number of 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea is 372087-70-2.
What is the molecular formula of 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
The molecular formula of 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea is C17H12Cl5N3O4.
What is the molecular weight of 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
The molecular weight of 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea is 496.93 g/mol.
Where can I buy 1-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
You can request a quote for 1-(2,4-Dichlorophenyl)-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-(2,4-Dichlorophenyl)-3-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dichlorophenyl)-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.