Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate
TL;DR: Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate (CAS 349128-27-4) is a chemical compound with molecular formula C14H17ClN2O3 and molecular weight 296.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3-chlorobenzoyl)piperazine-1-carboxylate
Also Known As: ethyl 4-(3-chlorobenzoyl)piperazine-1-carboxylate, ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate, ethyl 4-[(3-chlorophenyl)carbonyl]piperazine-1-carboxylate, ETHYL 4-(3-CHLOROBENZOYL)TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
| Molecular Formula | C14H17ClN2O3 |
|---|---|
| Molecular Weight | 296.09 g/mol |
| LogP | 2.2543 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.09277 |
| Heavy Atoms | 20 |
| Complexity | 498.94733 |
Chemical Identifiers
| CAS Number | 349128-27-4 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)Cl |
Product Overview
Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate (CAS 349128-27-4), with molecular formula C14H17ClN2O3 and molecular weight 296.09 g/mol. IUPAC: ethyl 4-(3-chlorobenzoyl)piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate
Property Insights of Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate
The XLogP value of 2.2543 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate. With a topological polar surface area (TPSA) of 49.85 Ų, Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate has 0 hydrogen bond donor(s) and 3 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-[(3-chlorophenyl)carbonyl]piperazinecarboxylate?
The CAS number of Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate is 349128-27-4.
What is the molecular formula of Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate?
The molecular formula of Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate is C14H17ClN2O3.
What is the molecular weight of Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate?
The molecular weight of Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate is 296.09 g/mol.
Where can I buy Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate?
You can request a quote for Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(3-chlorophenyl)carbonyl]piperazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.