4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole
TL;DR: 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole (CAS 1165792-34-6) is a chemical compound with molecular formula C11H10N4O2 and molecular weight 230.08037 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(5-methyl-1H-pyrazol-4-yl)-1-(4-nitrophenyl)methanimine
Also Known As: 4-({4-Nitrobenzylidene}, 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole, N-(5-methyl-1H-pyrazol-4-yl)-1-(4-nitrophenyl)methanimine
Technical Specifications
| Molecular Formula | C11H10N4O2 |
| Molecular Weight | 230.08037 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 86.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.08037 Da |
| Heavy Atoms | 17 |
| Complexity | 294.0 |
| SMILES | CC1=C(C=NN1)N=CC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | NHWMLYBXNNEKQZ-UHFFFAOYSA-N |
Chemical Property Profile of 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole
Property Insights of 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole. Following Lipinski's Rule of Five, 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole 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
What is the CAS number of 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole?
The CAS number of 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole is 1165792-34-6.
What is the molecular formula of 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole?
The molecular formula of 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole is C11H10N4O2.
What is the molecular weight of 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole?
The molecular weight of 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole is 230.08037 g/mol.
Where can I buy 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole?
You can request a quote for 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 4-({4-nitrobenzylidene}amino)-3-methyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.