Urea, 1-acetyl-3-(2,2-dichloroethyl)-
TL;DR: Urea, 1-acetyl-3-(2,2-dichloroethyl)- (CAS 69225-98-5) is a chemical compound with molecular formula C5H8Cl2N2O2 and molecular weight 198.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,2-dichloroethylcarbamoyl)acetamide
Also Known As: 1-Acetyl-3-(2,2-dichloroethyl)urea, Urea, 1-acetyl-3-(2,2-dichloroethyl)-, N-(2,2-dichloroethylcarbamoyl)acetamide, N-[(2,2-Dichloroethyl)carbamoyl]acetamide, 3-04-00-00247 (Beilstein Handbook Reference)
| Molecular Formula | C5H8Cl2N2O2 |
|---|---|
| Molecular Weight | 198.00 g/mol |
| LogP | 0.6358 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.99628 |
| Heavy Atoms | 11 |
| Complexity | 160.5614 |
Chemical Identifiers
| CAS Number | 69225-98-5 |
|---|---|
| SMILES | CC(=O)NC(=O)NCC(Cl)Cl |
Product Overview
Urea, 1-acetyl-3-(2,2-dichloroethyl)- (CAS 69225-98-5), with molecular formula C5H8Cl2N2O2 and molecular weight 198.00 g/mol. IUPAC: N-(2,2-dichloroethylcarbamoyl)acetamide.
Chemical Property Profile of Urea, 1-acetyl-3-(2,2-dichloroethyl)-
Property Insights of Urea, 1-acetyl-3-(2,2-dichloroethyl)-
The XLogP value of 0.6358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-acetyl-3-(2,2-dichloroethyl)-. With a topological polar surface area (TPSA) of 58.2 Ų, Urea, 1-acetyl-3-(2,2-dichloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-acetyl-3-(2,2-dichloroethyl)- has 2 hydrogen bond donor(s) and 2 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-acetyl-3-(2,2-dichloroethyl)-?
The CAS number of Urea, 1-acetyl-3-(2,2-dichloroethyl)- is 69225-98-5.
What is the molecular formula of Urea, 1-acetyl-3-(2,2-dichloroethyl)-?
The molecular formula of Urea, 1-acetyl-3-(2,2-dichloroethyl)- is C5H8Cl2N2O2.
What is the molecular weight of Urea, 1-acetyl-3-(2,2-dichloroethyl)-?
The molecular weight of Urea, 1-acetyl-3-(2,2-dichloroethyl)- is 198.00 g/mol.
Where can I buy Urea, 1-acetyl-3-(2,2-dichloroethyl)-?
You can request a quote for Urea, 1-acetyl-3-(2,2-dichloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-acetyl-3-(2,2-dichloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-acetyl-3-(2,2-dichloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.