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Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate
TL;DR: Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate (CAS 330459-53-5) is a chemical compound with molecular formula C15H19ClN2O4 and molecular weight 326.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(4-chlorophenoxy)acetyl]piperazine-1-carboxylate
Also Known As: BAS 03193645, ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate, ethyl 4-[2-(4-chlorophenoxy)acetyl]piperazinecarboxylate, 4-[2-(4-Chloro-phenoxy)-acetyl]-piperazine-1-carboxylic acid ethyl ester, ethyl 4-(2-(4-chlorophenoxy)acetyl)piperazine-1-carboxylate
| Molecular Formula | C15H19ClN2O4 |
|---|---|
| Molecular Weight | 326.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.10333 |
| Heavy Atoms | 22 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 330459-53-5 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)COC2=CC=C(C=C2)Cl |
| InChIKey | RFSZHVIEMRNVCZ-UHFFFAOYSA-N |
Product Overview
Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate (CAS 330459-53-5), with molecular formula C15H19ClN2O4 and molecular weight 326.10 g/mol. IUPAC: ethyl 4-[2-(4-chlorophenoxy)acetyl]piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate
Property Insights of Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate. With a topological polar surface area (TPSA) of 59.1 Ų, Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate has 0 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 Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate?
The CAS number of Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate is 330459-53-5.
What is the molecular formula of Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate?
The molecular formula of Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate is C15H19ClN2O4.
What is the molecular weight of Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate?
The molecular weight of Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate is 326.10 g/mol.
Where can I buy Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate?
You can request a quote for Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(4-chlorophenoxy)acetyl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.