![Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate structure](/static/products/5487/548775-49-1.webp)
Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate
TL;DR: Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate (CAS 548775-49-1) is a chemical compound with molecular formula C14H14N4O5 and molecular weight 318.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate
Also Known As: ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate, ethyl 1-methyl-5-(4-nitrobenzamido)-1H-pyrazole-4-carboxylate
| Molecular Formula | C14H14N4O5 |
|---|---|
| Molecular Weight | 318.10 g/mol |
| LogP | 1.7573 |
| Topological Polar Surface Area | 116.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.0964 |
| Heavy Atoms | 23 |
| Complexity | 751.02814 |
Chemical Identifiers
| CAS Number | 548775-49-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1)C)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate (CAS 548775-49-1), with molecular formula C14H14N4O5 and molecular weight 318.10 g/mol. IUPAC: ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate.
Chemical Property Profile of Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate
Property Insights of Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate
The XLogP value of 1.7573 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate. The TPSA of 116.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate has 1 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 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate?
The CAS number of Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate is 548775-49-1.
What is the molecular formula of Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate?
The molecular formula of Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate is C14H14N4O5.
What is the molecular weight of Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate?
The molecular weight of Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate is 318.10 g/mol.
Where can I buy Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate?
You can request a quote for Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-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-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-methyl-5-[(4-nitrobenzoyl)amino]pyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.