TL;DR: (E)-N'-(4-nitrobenzylidene)-3-(4-phenethoxyphenyl)-1H-pyrazole-5-carbohydrazide (CAS 1027610-99-6) is a chemical compound with molecular formula C25H21N5O4 and molecular weight 455.15936 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(4-nitrophenyl)methylideneamino]-3-[4-(2-phenylethoxy)phenyl]-1H-pyrazole-5-carboxamide
Also Known As: (E)-N'-(4-nitrobenzylidene)-3-(4-phenethoxyphenyl)-1H-pyrazole-5-carbohydrazide, N'-(4-NITROBENZYLIDENE)-3-(4-(2-PHENYLETHOXY)PH)-1H-PYRAZOLE-5-CARBOHYDRAZIDE, N-[(4-nitrophenyl)methylideneamino]-5-(4-phenethyloxyphenyl)-2H-pyrazole-3-carboxamide, N-[(E)-(4-nitrophenyl)methylideneamino]-3-(4-phenethyloxyphenyl)-1H-pyrazole-5-carboxamide, N'-[(E)-(4-nitrophenyl)methylidene]-3-[4-(2-phenylethoxy)phenyl]-1H-pyrazole-5-carbohydrazide
| Molecular Formula | C25H21N5O4 |
| Molecular Weight | 455.15936 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 455.15936 Da |
| Heavy Atoms | 34 |
| Complexity | 677.0 |
| SMILES | C1=CC=C(C=C1)CCOC2=CC=C(C=C2)C3=NNC(=C3)C(=O)N/N=C/C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | WDSYAQCPMCZONT-YZSQISJMSA-N |
The XLogP value of 4.9 indicates that (E)-N'-(4-nitrobenzylidene)-3-(4-phenethoxyphenyl)-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(4-nitrobenzylidene)-3-(4-phenethoxyphenyl)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (E)-N'-(4-nitrobenzylidene)-3-(4-phenethoxyphenyl)-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'-(4-nitrobenzylidene)-3-(4-phenethoxyphenyl)-1H-pyrazole-5-carbohydrazide is 1027610-99-6.
The molecular formula of (E)-N'-(4-nitrobenzylidene)-3-(4-phenethoxyphenyl)-1H-pyrazole-5-carbohydrazide is C25H21N5O4.
The molecular weight of (E)-N'-(4-nitrobenzylidene)-3-(4-phenethoxyphenyl)-1H-pyrazole-5-carbohydrazide is 455.15936 g/mol.
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