TL;DR: N'-(4-Fluorobenzylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide (CAS 1285540-59-1) is a chemical compound with molecular formula C17H12FN5O3 and molecular weight 353.0924 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(4-fluorophenyl)methylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
Also Known As: N'-(4-Fluorobenzylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide, (E)-N'-(4-fluorobenzylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide, N'-[(E)-(4-fluorophenyl)methylidene]-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide, N-[(1E)-2-(4-fluorophenyl)-1-azavinyl][3-(3-nitrophenyl)pyrazol-5-yl]carboxami de, N-[(E)-(4-fluorophenyl)methylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
| Molecular Formula | C17H12FN5O3 |
| Molecular Weight | 353.0924 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.0924 Da |
| Heavy Atoms | 26 |
| Complexity | 533.0 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)F |
| InChIKey | YIZWKMQCMIDPAO-VXLYETTFSA-N |
The XLogP value of 3.0 indicates that N'-(4-Fluorobenzylidene)-3-(3-nitrophenyl)-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 N'-(4-Fluorobenzylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, N'-(4-Fluorobenzylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N'-(4-Fluorobenzylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide is 1285540-59-1.
The molecular formula of N'-(4-Fluorobenzylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide is C17H12FN5O3.
The molecular weight of N'-(4-Fluorobenzylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide is 353.0924 g/mol.
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