TL;DR: (E)-N'-(2-chloro-6-fluorobenzylidene)-3-(4-((4-chlorobenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide (CAS 1284279-82-8) is a chemical compound with molecular formula C24H17Cl2FN4O2 and molecular weight 482.07126 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-[4-[(4-chlorophenyl)methoxy]phenyl]-1H-pyrazole-5-carboxamide
Also Known As: (E)-N'-(2-chloro-6-fluorobenzylidene)-3-(4-((4-chlorobenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide, 3-{4-[(4-CHLOROBENZYL)OXY]PHENYL}-N'-[(E)-(2-CHLORO-6-FLUOROPHENYL)METHYLIDENE]-1H-PYRAZOLE-5-CARBOHYDRAZIDE, 5-{4-[(4-chlorobenzyl)oxy]phenyl}-N'-[(E)-(2-chloro-6-fluorophenyl)methylidene]-1H-pyrazole-3-carbohydrazide, N-[(1E)-2-(2-chloro-6-fluorophenyl)-1-azavinyl](3-{4-[(4-chlorophenyl)methoxy] phenyl}pyrazol-5-yl)carboxamide, N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-[4-[(4-chlorophenyl)methoxy]phenyl]-1H-pyrazole-5-carboxamide
| Molecular Formula | C24H17Cl2FN4O2 |
| Molecular Weight | 482.07126 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 79.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 482.07126 Da |
| Heavy Atoms | 33 |
| Complexity | 656.0 |
| SMILES | C1=CC(=C(C(=C1)Cl)/C=N/NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl)F |
| InChIKey | KJOUBSNUWRCABU-XODNFHPESA-N |
The XLogP value of 5.9 indicates that (E)-N'-(2-chloro-6-fluorobenzylidene)-3-(4-((4-chlorobenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(2-chloro-6-fluorobenzylidene)-3-(4-((4-chlorobenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (E)-N'-(2-chloro-6-fluorobenzylidene)-3-(4-((4-chlorobenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (E)-N'-(2-chloro-6-fluorobenzylidene)-3-(4-((4-chlorobenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide is 1284279-82-8.
The molecular formula of (E)-N'-(2-chloro-6-fluorobenzylidene)-3-(4-((4-chlorobenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide is C24H17Cl2FN4O2.
The molecular weight of (E)-N'-(2-chloro-6-fluorobenzylidene)-3-(4-((4-chlorobenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide is 482.07126 g/mol.
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