TL;DR: 3-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide (CAS 1310114-71-6) is a chemical compound with molecular formula C26H24N4O4 and molecular weight 456.17975 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-methoxy-4-phenylmethoxyphenyl)-N-[(E)-(4-methoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: 3-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide, (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-N'-(4-methoxybenzylidene)-1H-pyrazole-5-carbohydrazide, 3-(3-methoxy-4-phenylmethoxyphenyl)-N-[(E)-(4-methoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
| Molecular Formula | C26H24N4O4 |
| Molecular Weight | 456.17975 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 97.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 456.17975 Da |
| Heavy Atoms | 34 |
| Complexity | 649.0 |
| SMILES | COC1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NN2)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC |
| InChIKey | HXUBEUBVDHDLOG-JVWAILMASA-N |
The XLogP value of 4.5 indicates that 3-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(4-methoxyphenyl)methylidene]-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 3-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, 3-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(4-methoxyphenyl)methylidene]-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 3-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide is 1310114-71-6.
The molecular formula of 3-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide is C26H24N4O4.
The molecular weight of 3-[4-(benzyloxy)-3-methoxyphenyl]-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide is 456.17975 g/mol.
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