TL;DR: N'-[(E)-(3-fluorophenyl)methylidene]-3-nitrobenzohydrazide (CAS 1381862-47-0) is a chemical compound with molecular formula C14H10FN3O3 and molecular weight 287.07062 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(3-fluorophenyl)methylideneamino]-3-nitrobenzamide
Also Known As: (E)-N'-(3-Fluorobenzylidene)-3-nitrobenzohydrazide, N'-[(E)-(3-fluorophenyl)methylidene]-3-nitrobenzohydrazide, N-[(E)-(3-fluorophenyl)methylideneamino]-3-nitrobenzamide, N-[(1E)-2-(3-fluorophenyl)-1-azavinyl](3-nitrophenyl)carboxamide
| Molecular Formula | C14H10FN3O3 |
| Molecular Weight | 287.07062 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 87.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.07062 Da |
| Heavy Atoms | 21 |
| Complexity | 411.0 |
| SMILES | C1=CC(=CC(=C1)F)/C=N/NC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | CUQBYPWDYZXLMI-CXUHLZMHSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[(E)-(3-fluorophenyl)methylidene]-3-nitrobenzohydrazide. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[(E)-(3-fluorophenyl)methylidene]-3-nitrobenzohydrazide. Following Lipinski's Rule of Five, N'-[(E)-(3-fluorophenyl)methylidene]-3-nitrobenzohydrazide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N'-[(E)-(3-fluorophenyl)methylidene]-3-nitrobenzohydrazide is 1381862-47-0.
The molecular formula of N'-[(E)-(3-fluorophenyl)methylidene]-3-nitrobenzohydrazide is C14H10FN3O3.
The molecular weight of N'-[(E)-(3-fluorophenyl)methylidene]-3-nitrobenzohydrazide is 287.07062 g/mol.
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