TL;DR: (E)-N'-(2,5-dimethoxybenzylidene)-3-(4-((4-methylbenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide (CAS 1285531-41-0) is a chemical compound with molecular formula C27H26N4O4 and molecular weight 470.1954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(2,5-dimethoxyphenyl)methylideneamino]-3-[4-[(4-methylphenyl)methoxy]phenyl]-1H-pyrazole-5-carboxamide
Also Known As: (E)-N'-(2,5-dimethoxybenzylidene)-3-(4-((4-methylbenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide, N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-3-{4-[(4-methylbenzyl)oxy]phenyl}-1H-pyrazole-5-carbohydrazide, N-[(1E)-2-(2,5-dimethoxyphenyl)-1-azavinyl](3-{4-[(4-methylphenyl)methoxy]phen yl}pyrazol-5-yl)carboxamide, N-[(E)-(2,5-dimethoxyphenyl)methylideneamino]-3-[4-[(4-methylphenyl)methoxy]phenyl]-1H-pyrazole-5-carboxamide
| Molecular Formula | C27H26N4O4 |
| Molecular Weight | 470.1954 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 97.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 470.1954 Da |
| Heavy Atoms | 35 |
| Complexity | 676.0 |
| SMILES | CC1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NNC(=C3)C(=O)N/N=C/C4=C(C=CC(=C4)OC)OC |
| InChIKey | VXKJQOURHUTXLC-LQKURTRISA-N |
The XLogP value of 4.9 indicates that (E)-N'-(2,5-dimethoxybenzylidene)-3-(4-((4-methylbenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(2,5-dimethoxybenzylidene)-3-(4-((4-methylbenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (E)-N'-(2,5-dimethoxybenzylidene)-3-(4-((4-methylbenzyl)oxy)phenyl)-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 (E)-N'-(2,5-dimethoxybenzylidene)-3-(4-((4-methylbenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide is 1285531-41-0.
The molecular formula of (E)-N'-(2,5-dimethoxybenzylidene)-3-(4-((4-methylbenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide is C27H26N4O4.
The molecular weight of (E)-N'-(2,5-dimethoxybenzylidene)-3-(4-((4-methylbenzyl)oxy)phenyl)-1H-pyrazole-5-carbohydrazide is 470.1954 g/mol.
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