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Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate
TL;DR: Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate (CAS 650588-06-0) is a chemical compound with molecular formula C17H24N2O4 and molecular weight 320.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(2,4-dimethylphenoxy)acetyl]piperazine-1-carboxylate
Also Known As: BAS 08979147, ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate, AN-329/13206057, ethyl 4-[2-(2,4-dimethylphenoxy)acetyl]piperazine-1-carboxylate, ethyl 4-[(2,4-dimethylphenoxy)acetyl]piperazine-1-carboxylate
| Molecular Formula | C17H24N2O4 |
|---|---|
| Molecular Weight | 320.17 g/mol |
| LogP | 1.98294 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.1736 |
| Heavy Atoms | 23 |
| Complexity | 565.71185 |
Chemical Identifiers
| CAS Number | 650588-06-0 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)COC2=C(C=C(C=C2)C)C |
Product Overview
Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate (CAS 650588-06-0), with molecular formula C17H24N2O4 and molecular weight 320.17 g/mol. IUPAC: ethyl 4-[2-(2,4-dimethylphenoxy)acetyl]piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate
Property Insights of Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate
The XLogP value of 1.98294 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate. With a topological polar surface area (TPSA) of 59.08 Ų, Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate has 0 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-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate?
The CAS number of Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate is 650588-06-0.
What is the molecular formula of Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate?
The molecular formula of Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate is C17H24N2O4.
What is the molecular weight of Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate?
The molecular weight of Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate is 320.17 g/mol.
Where can I buy Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate?
You can request a quote for Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(2,4-dimethylphenoxy)acetyl]-1-piperazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.