![Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate structure](/static/products/765/765918-91-0.png)
Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
TL;DR: Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate (CAS 765918-91-0) is a chemical compound with molecular formula C24H29N3O4 and molecular weight 423.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-benzoylpiperazin-1-yl)-3-(butanoylamino)benzoate
Also Known As: ethyl 4-(4-benzoylpiperazin-1-yl)-3-butyramidobenzoate, ethyl 4-(4-benzoylpiperazin-1-yl)-3-(butanoylamino)benzoate, ETHYL 4-(4-BENZOYLPIPERAZIN-1-YL)-3-BUTANAMIDOBENZOATE, ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
| Molecular Formula | C24H29N3O4 |
|---|---|
| Molecular Weight | 423.22 g/mol |
| LogP | 3.5643 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 423.21582 |
| Heavy Atoms | 31 |
| Complexity | 921.6766 |
Chemical Identifiers
| CAS Number | 765918-91-0 |
|---|---|
| SMILES | CCCC(=O)NC1=C(C=CC(=C1)C(=O)OCC)N2CCN(CC2)C(=O)C3=CC=CC=C3 |
Product Overview
Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate (CAS 765918-91-0), with molecular formula C24H29N3O4 and molecular weight 423.22 g/mol. IUPAC: ethyl 4-(4-benzoylpiperazin-1-yl)-3-(butanoylamino)benzoate.
Chemical Property Profile of Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Property Insights of Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
The XLogP value of 3.5643 indicates that Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate. Following Lipinski's Rule of Five, Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate 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-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate?
The CAS number of Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate is 765918-91-0.
What is the molecular formula of Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate?
The molecular formula of Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate is C24H29N3O4.
What is the molecular weight of Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate?
The molecular weight of Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate is 423.22 g/mol.
Where can I buy Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate?
You can request a quote for Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(butanoylamino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.