Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate
TL;DR: Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate (CAS 694498-72-1) is a chemical compound with molecular formula C19H22N2O3 and molecular weight 326.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-naphthalen-1-ylacetyl)piperazine-1-carboxylate
Also Known As: BAS 06838442, ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate, ETHYL 4-(2-NAPHTHYLACETYL)PIPERAZINECARBOXYLATE, ethyl 4-(2-naphthalen-1-ylacetyl)piperazine-1-carboxylate, ethyl 4-[2-(1-naphthyl)acetyl]piperazine-1-carboxylate
| Molecular Formula | C19H22N2O3 |
|---|---|
| Molecular Weight | 326.16 g/mol |
| LogP | 2.683 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.16306 |
| Heavy Atoms | 24 |
| Complexity | 730.97424 |
Chemical Identifiers
| CAS Number | 694498-72-1 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CC2=CC=CC3=CC=CC=C32 |
Product Overview
Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate (CAS 694498-72-1), with molecular formula C19H22N2O3 and molecular weight 326.16 g/mol. IUPAC: ethyl 4-(2-naphthalen-1-ylacetyl)piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate
Property Insights of Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate
The XLogP value of 2.683 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate. With a topological polar surface area (TPSA) of 49.85 Ų, Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-[2-(naphthalen-1-yl)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-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate?
The CAS number of Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate is 694498-72-1.
What is the molecular formula of Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate?
The molecular formula of Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate is C19H22N2O3.
What is the molecular weight of Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate?
The molecular weight of Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate is 326.16 g/mol.
Where can I buy Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate?
You can request a quote for Ethyl 4-[2-(naphthalen-1-yl)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-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[2-(naphthalen-1-yl)acetyl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.