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Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate
TL;DR: Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate (CAS 318288-60-7) is a chemical compound with molecular formula C16H20N2O4 and molecular weight 304.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[1-(4-methylbenzoyl)-3-oxopiperazin-2-yl]acetate
Also Known As: ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate, ethyl 2-[1-(4-methylbenzoyl)-3-oxopiperazin-2-yl]acetate, ethyl2-[1-(4-methylbenzoyl)-3-oxopiperazin-2-yl]acetate, ethyl 2-[1-(4-methylbenzoyl)-3-oxo-piperazin-2-yl]acetate
| Molecular Formula | C16H20N2O4 |
|---|---|
| Molecular Weight | 304.14 g/mol |
| LogP | 0.88882 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.1423 |
| Heavy Atoms | 22 |
| Complexity | 568.0135 |
Chemical Identifiers
| CAS Number | 318288-60-7 |
|---|---|
| SMILES | CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)C |
Product Overview
Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate (CAS 318288-60-7), with molecular formula C16H20N2O4 and molecular weight 304.14 g/mol. IUPAC: ethyl 2-[1-(4-methylbenzoyl)-3-oxopiperazin-2-yl]acetate.
Chemical Property Profile of Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate
Property Insights of Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate
The XLogP value of 0.88882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate. Following Lipinski's Rule of Five, Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate 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 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate?
The CAS number of Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate is 318288-60-7.
What is the molecular formula of Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate?
The molecular formula of Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate is C16H20N2O4.
What is the molecular weight of Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate?
The molecular weight of Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate is 304.14 g/mol.
Where can I buy Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate?
You can request a quote for Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[1-(4-methylbenzoyl)-3-oxo-2-piperazinyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.