![ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate structure](/static/products/4288/428847-25-0.webp)
ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate
TL;DR: ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate (CAS 428847-25-0) is a chemical compound with molecular formula C16H22ClN3O3 and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(3-chloroanilino)-3-oxopropyl]piperazine-1-carboxylate
Also Known As: BAS 03086733, ethyl 4-[3-(3-chloroanilino)-3-oxopropyl]piperazine-1-carboxylate, ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate, ethyl 4-(3-((3-chlorophenyl)amino)-3-oxopropyl)piperazine-1-carboxylate, ethyl 4-{3-[(3-chlorophenyl)amino]-3-oxopropyl}piperazine-1-carboxylate
| Molecular Formula | C16H22ClN3O3 |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 2.4427 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.13498 |
| Heavy Atoms | 23 |
| Complexity | 545.12695 |
Chemical Identifiers
| CAS Number | 428847-25-0 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CCC(=O)NC2=CC(=CC=C2)Cl |
Product Overview
ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate (CAS 428847-25-0), with molecular formula C16H22ClN3O3 and molecular weight 339.13 g/mol. IUPAC: ethyl 4-[3-(3-chloroanilino)-3-oxopropyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate
Property Insights of ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate
The XLogP value of 2.4427 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate. Following Lipinski's Rule of Five, ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate has 1 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-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate?
The CAS number of ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate is 428847-25-0.
What is the molecular formula of ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate?
The molecular formula of ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate is C16H22ClN3O3.
What is the molecular weight of ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate?
The molecular weight of ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate is 339.13 g/mol.
Where can I buy ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate?
You can request a quote for ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}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-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-{2-[N-(3-chlorophenyl)carbamoyl]ethyl}piperazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.