Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-
TL;DR: Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl- (CAS 69225-97-4) is a chemical compound with molecular formula C7H9Cl3N2O4 and molecular weight 289.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(acetylcarbamoylamino)-2,2,2-trichloroethyl] acetate
Also Known As: 1-(1-Acetoxy-2,2,2-trichloroethyl)-3-acetylurea, 3-03-00-00120 (Beilstein Handbook Reference), Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-, 1-[1- -2,2,2-trichloroethyl]-3-acetylurea, [1-(acetylcarbamoylamino)-2,2,2-trichloroethyl] acetate
| Molecular Formula | C7H9Cl3N2O4 |
|---|---|
| Molecular Weight | 289.96 g/mol |
| LogP | 1.0915 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.9628 |
| Heavy Atoms | 16 |
| Complexity | 302.49728 |
Chemical Identifiers
| CAS Number | 69225-97-4 |
|---|---|
| SMILES | CC(=O)NC(=O)NC(C(Cl)(Cl)Cl)OC(=O)C |
Product Overview
Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl- (CAS 69225-97-4), with molecular formula C7H9Cl3N2O4 and molecular weight 289.96 g/mol. IUPAC: [1-(acetylcarbamoylamino)-2,2,2-trichloroethyl] acetate.
Chemical Property Profile of Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-
Property Insights of Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-
The XLogP value of 1.0915 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-. Following Lipinski's Rule of Five, Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-?
The CAS number of Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl- is 69225-97-4.
What is the molecular formula of Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-?
The molecular formula of Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl- is C7H9Cl3N2O4.
What is the molecular weight of Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-?
The molecular weight of Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl- is 289.96 g/mol.
Where can I buy Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-?
You can request a quote for Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(1-acetoxy-2,2,2-trichloroethyl)-3-acetyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.