![Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate structure](/static/products/1008/1008015-48-2.webp)
Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate
TL;DR: Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate (CAS 1008015-48-2) is a chemical compound with molecular formula C15H18ClFN2O3 and molecular weight 328.099 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[1-[(4-chloro-3-fluorophenyl)methyl]-3-oxopiperazin-2-yl]acetate
Also Known As: BAS 12524916, ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxo-2-piperazinyl]acetate, ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate, ethyl 2-(1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl)acetate, ethyl 2-[1-[(4-chloro-3-fluorophenyl)methyl]-3-oxopiperazin-2-yl]acetate
Technical Specifications
| Molecular Formula | C15H18ClFN2O3 |
| Molecular Weight | 328.099 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.099 Da |
| Heavy Atoms | 22 |
| Complexity | 410.0 |
| SMILES | CCOC(=O)CC1C(=O)NCCN1CC2=CC(=C(C=C2)Cl)F |
| InChIKey | OWCWJGQSNBHACG-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate
Property Insights of Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate. With a topological polar surface area (TPSA) of 58.6 Ų, Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate 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
What is the CAS number of Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate?
The CAS number of Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate is 1008015-48-2.
What is the molecular formula of Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate?
The molecular formula of Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate is C15H18ClFN2O3.
What is the molecular weight of Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate?
The molecular weight of Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate is 328.099 g/mol.
Where can I buy Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate?
You can request a quote for Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate?
Yes, CoreyChem provides custom synthesis services for Ethyl [1-(4-chloro-3-fluorobenzyl)-3-oxopiperazin-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.