![Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate structure](/static/products/1009/1009688-47-4.webp)
Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate
TL;DR: Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate (CAS 1009688-47-4) is a chemical compound with molecular formula C18H24N4O5 and molecular weight 376.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl]amino]benzoate
Also Known As: ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate, ethyl 4-[[2-[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl]amino]benzoate, ethyl 4-[({1-[(ethylamino)carbonyl]-3-oxo-2-piperazinyl}acetyl)amino]benzoate, ethyl 4-(2-(1-(ethylcarbamoyl)-3-oxopiperazin-2-yl)acetamido)benzoate, ethyl 4-{2-[1-(N-ethylcarbamoyl)-3-oxopiperazin-2-yl]acetylamino}benzoate
| Molecular Formula | C18H24N4O5 |
|---|---|
| Molecular Weight | 376.17 g/mol |
| LogP | 0.7218 |
| Topological Polar Surface Area | 116.84 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.17468 |
| Heavy Atoms | 27 |
| Complexity | 704.20844 |
Chemical Identifiers
| CAS Number | 1009688-47-4 |
|---|---|
| SMILES | CCNC(=O)N1CCNC(=O)C1CC(=O)NC2=CC=C(C=C2)C(=O)OCC |
Product Overview
Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate (CAS 1009688-47-4), with molecular formula C18H24N4O5 and molecular weight 376.17 g/mol. IUPAC: ethyl 4-[[2-[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate
Property Insights of Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate
The XLogP value of 0.7218 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate. The TPSA of 116.84 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate. Following Lipinski's Rule of Five, Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate has 3 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 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate?
The CAS number of Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate is 1009688-47-4.
What is the molecular formula of Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate?
The molecular formula of Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate is C18H24N4O5.
What is the molecular weight of Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate?
The molecular weight of Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate is 376.17 g/mol.
Where can I buy Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate?
You can request a quote for Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-({[1-(ethylcarbamoyl)-3-oxopiperazin-2-yl]acetyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.