N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide
TL;DR: N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide (CAS 492422-66-9) is a chemical compound with molecular formula C14H16N4O3 and molecular weight 288.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-dimethylphenyl)-1-ethyl-4-nitropyrazole-5-carboxamide
Also Known As: BAS 06331180, N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide, N-(2,6-dimethylphenyl)-2-ethyl-4-nitropyrazole-3-carboxamide, 2-Ethyl-4-nitro-2H-pyrazole-3-carboxylic acid (2,6-dimethyl-phenyl)-amide, N-(2,6-dimethylphenyl)(1-ethyl-4-nitropyrazol-5-yl)carboxamide
| Molecular Formula | C14H16N4O3 |
|---|---|
| Molecular Weight | 288.12 g/mol |
| LogP | 2.68034 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.12225 |
| Heavy Atoms | 21 |
| Complexity | 685.9898 |
Chemical Identifiers
| CAS Number | 492422-66-9 |
|---|---|
| SMILES | CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=C(C=CC=C2C)C |
Product Overview
N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide (CAS 492422-66-9), with molecular formula C14H16N4O3 and molecular weight 288.12 g/mol. IUPAC: N-(2,6-dimethylphenyl)-1-ethyl-4-nitropyrazole-5-carboxamide.
Chemical Property Profile of N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide
Property Insights of N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide
The XLogP value of 2.68034 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide has 1 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 N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide?
The CAS number of N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide is 492422-66-9.
What is the molecular formula of N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide?
The molecular formula of N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide is C14H16N4O3.
What is the molecular weight of N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide?
The molecular weight of N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide is 288.12 g/mol.
Where can I buy N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide?
You can request a quote for N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,6-dimethylphenyl)-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.