![Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate structure](/static/products/898/898055-83-9.png)
Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate
TL;DR: Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate (CAS 898055-83-9) is a chemical compound with molecular formula C12H17N5O5 and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate
Also Known As: Ethyl 4-[2-(4-nitro-1H-pyrazol-1-yl)acetyl]-1-piperazinecarboxylate, ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate, ethyl 4-[2-(4-nitropyrazolyl)acetyl]piperazinecarboxylate, ethyl 4-[(4-nitro-1H-pyrazol-1-yl)acetyl]-1-piperazinecarboxylate, Ethyl 4-[(4-nitro-1H-pyrazol-1-yl)acetyl]piperazine-1-carboxylate
| Molecular Formula | C12H17N5O5 |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 0.092 |
| Topological Polar Surface Area | 110.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.12296 |
| Heavy Atoms | 22 |
| Complexity | 564.0081 |
Chemical Identifiers
| CAS Number | 898055-83-9 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CN2C=C(C=N2)[N+](=O)[O-] |
Product Overview
Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate (CAS 898055-83-9), with molecular formula C12H17N5O5 and molecular weight 311.12 g/mol. IUPAC: ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate
Property Insights of Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate
The XLogP value of 0.092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate. The TPSA of 110.81 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate has 0 hydrogen bond donor(s) and 6 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-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate?
The CAS number of Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate is 898055-83-9.
What is the molecular formula of Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate?
The molecular formula of Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate is C12H17N5O5.
What is the molecular weight of Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate?
The molecular weight of Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate is 311.12 g/mol.
Where can I buy Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate?
You can request a quote for Ethyl 4-[2-(4-nitropyrazol-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-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[2-(4-nitropyrazol-1-yl)acetyl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.