![Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate structure](/static/products/3384/338406-20-5.webp)
Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate
TL;DR: Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate (CAS 338406-20-5) is a chemical compound with molecular formula C15H20ClN3O2 and molecular weight 309.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-amino-3-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-enoate
Also Known As: ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate, 3F-914, ethyl (E)-3-amino-3-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-enoate, ethyl (2E)-3-amino-3-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-enoate, ethyl(2E)-3-amino-3-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-enoate
| Molecular Formula | C15H20ClN3O2 |
|---|---|
| Molecular Weight | 309.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 58.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.1244 |
| Heavy Atoms | 21 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 338406-20-5 |
|---|---|
| SMILES | CCOC(=O)/C=C(\N)/N1CCN(CC1)C2=CC(=CC=C2)Cl |
| InChIKey | IWWVFSNQFNIWEE-SDNWHVSQSA-N |
Product Overview
Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate (CAS 338406-20-5), with molecular formula C15H20ClN3O2 and molecular weight 309.12 g/mol. IUPAC: ethyl (E)-3-amino-3-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-enoate.
Chemical Property Profile of Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate
Property Insights of Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate
The XLogP value of 3.1 indicates that Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.8 Ų, Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate has 1 hydrogen bond donor(s) and 5 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 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate?
The CAS number of Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate is 338406-20-5.
What is the molecular formula of Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate?
The molecular formula of Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate is C15H20ClN3O2.
What is the molecular weight of Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate?
The molecular weight of Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate is 309.12 g/mol.
Where can I buy Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate?
You can request a quote for Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-amino-3-[4-(3-chlorophenyl)piperazino]acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.