Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate
TL;DR: Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate (CAS 671793-47-8) is a chemical compound with molecular formula C10H16N2O4 and molecular weight 228.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate
Also Known As: ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate, ethyl 4-oxo-4-(3-oxopiperazinyl)butanoate, ethyl 4-oxo-4-(3-oxo-1-piperazinyl)butanoate
| Molecular Formula | C10H16N2O4 |
|---|---|
| Molecular Weight | 228.11 g/mol |
| LogP | -0.7119 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.11101 |
| Heavy Atoms | 16 |
| Complexity | 290.5436 |
Chemical Identifiers
| CAS Number | 671793-47-8 |
|---|---|
| SMILES | CCOC(=O)CCC(=O)N1CCNC(=O)C1 |
Product Overview
Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate (CAS 671793-47-8), with molecular formula C10H16N2O4 and molecular weight 228.11 g/mol. IUPAC: ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate.
Chemical Property Profile of Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate
Property Insights of Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate
The XLogP value of -0.7119 indicates that Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate. Following Lipinski's Rule of Five, Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate 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-oxo-4-(3-oxopiperazin-1-yl)butanoate?
The CAS number of Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate is 671793-47-8.
What is the molecular formula of Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate?
The molecular formula of Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate is C10H16N2O4.
What is the molecular weight of Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate?
The molecular weight of Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate is 228.11 g/mol.
Where can I buy Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate?
You can request a quote for Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-oxo-4-(3-oxopiperazin-1-yl)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.