Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate
TL;DR: Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate (CAS 5986-88-9) is a chemical compound with molecular formula C25H26N4O6 and molecular weight 478.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[3-(4-methoxyphenyl)-1-(4-nitrophenyl)pyrazole-5-carbonyl]piperidine-3-carboxylate
Also Known As: Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate, Ethyl 1-[3-(4-methoxyphenyl)-1-(4-nitrophenyl)-1H-pyrazole-5-carbonyl]piperidine-3-carboxylate
| Molecular Formula | C25H26N4O6 |
|---|---|
| Molecular Weight | 478.19 g/mol |
| LogP | 3.8714 |
| Topological Polar Surface Area | 116.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.18524 |
| Heavy Atoms | 35 |
| Complexity | 1219.759 |
Chemical Identifiers
| CAS Number | 5986-88-9 |
|---|---|
| SMILES | CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OC |
Product Overview
Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate (CAS 5986-88-9), with molecular formula C25H26N4O6 and molecular weight 478.19 g/mol. IUPAC: ethyl 1-[3-(4-methoxyphenyl)-1-(4-nitrophenyl)pyrazole-5-carbonyl]piperidine-3-carboxylate.
Chemical Property Profile of Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate
Property Insights of Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate
The XLogP value of 3.8714 indicates that Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate has 0 hydrogen bond donor(s) and 7 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 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate?
The CAS number of Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate is 5986-88-9.
What is the molecular formula of Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate?
The molecular formula of Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate is C25H26N4O6.
What is the molecular weight of Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate?
The molecular weight of Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate is 478.19 g/mol.
Where can I buy Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate?
You can request a quote for Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-[5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.