(E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide
TL;DR: (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide (CAS 1285683-81-9) is a chemical compound with molecular formula C21H21N5O3 and molecular weight 391.16443 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-(2-methylpropyl)phenyl]-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide, 3-(4-isobutylphenyl)-N'-[(E)-(3-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide, 3-[4-(2-methylpropyl)phenyl]-N'-[(E)-(3-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide, 3-[4-(2-methylpropyl)phenyl]-N-[(E)-(3-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide, N-[(1E)-2-(3-nitrophenyl)-1-azavinyl]{3-[4-(2-methylpropyl)phenyl]pyrazol-5-yl }carboxamide
Technical Specifications
| Molecular Formula | C21H21N5O3 |
| Molecular Weight | 391.16443 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.16443 Da |
| Heavy Atoms | 29 |
| Complexity | 583.0 |
| SMILES | CC(C)CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC(=CC=C3)[N+](=O)[O-] |
| InChIKey | KZSIHYLQEGXVQN-LPYMAVHISA-N |
Chemical Property Profile of (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide
Property Insights of (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide
The XLogP value of 4.5 indicates that (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
The CAS number of (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide is 1285683-81-9.
What is the molecular formula of (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
The molecular formula of (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide is C21H21N5O3.
What is the molecular weight of (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
The molecular weight of (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide is 391.16443 g/mol.
Where can I buy (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
You can request a quote for (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide?
Yes, CoreyChem provides custom synthesis services for (E)-3-(4-isobutylphenyl)-N'-(3-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.