Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate
TL;DR: Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate (CAS 694446-04-3) is a chemical compound with molecular formula C16H22N2O3 and molecular weight 290.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(4-methylphenyl)acetyl]piperazine-1-carboxylate
Also Known As: ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate, ethyl 4-(2-(p-tolyl)acetyl)piperazine-1-carboxylate, ethyl 4-[(4-methylphenyl)acetyl]-1-piperazinecarboxylate, ethyl 4-[2-(4-methylphenyl)acetyl]piperazine-1-carboxylate
| Molecular Formula | C16H22N2O3 |
|---|---|
| Molecular Weight | 290.16 g/mol |
| LogP | 1.83822 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.16306 |
| Heavy Atoms | 21 |
| Complexity | 490.74847 |
Chemical Identifiers
| CAS Number | 694446-04-3 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CC2=CC=C(C=C2)C |
Product Overview
Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate (CAS 694446-04-3), with molecular formula C16H22N2O3 and molecular weight 290.16 g/mol. IUPAC: ethyl 4-[2-(4-methylphenyl)acetyl]piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate
Property Insights of Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate
The XLogP value of 1.83822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate. With a topological polar surface area (TPSA) of 49.85 Ų, Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate has 0 hydrogen bond donor(s) and 3 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-[(4-methylphenyl)acetyl]piperazine-1-carboxylate?
The CAS number of Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate is 694446-04-3.
What is the molecular formula of Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate?
The molecular formula of Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate is C16H22N2O3.
What is the molecular weight of Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate?
The molecular weight of Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate is 290.16 g/mol.
Where can I buy Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate?
You can request a quote for Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(4-methylphenyl)acetyl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.