TL;DR: N'-[(E)-(3-nitrophenyl)methylidene]pyrazine-2-carbohydrazide (CAS 1206198-62-0) is a chemical compound with molecular formula C12H9N5O3 and molecular weight 271.07053 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(3-nitrophenyl)methylideneamino]pyrazine-2-carboxamide
Also Known As: (E)-N'-(3-nitrobenzylidene)pyrazine-2-carbohydrazide, N'-[(E)-(3-nitrophenyl)methylidene]pyrazine-2-carbohydrazide, N-[(E)-(3-nitrophenyl)methylideneamino]pyrazine-2-carboxamide, Pyrazine-2-carboxylic acid [1-(3-nitro-phenyl)-meth-(E)-ylidene]-hydrazide
| Molecular Formula | C12H9N5O3 |
| Molecular Weight | 271.07053 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.07053 Da |
| Heavy Atoms | 20 |
| Complexity | 382.0 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/NC(=O)C2=NC=CN=C2 |
| InChIKey | VVRJCXDPEFMBRZ-VIZOYTHASA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[(E)-(3-nitrophenyl)methylidene]pyrazine-2-carbohydrazide. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[(E)-(3-nitrophenyl)methylidene]pyrazine-2-carbohydrazide. Following Lipinski's Rule of Five, N'-[(E)-(3-nitrophenyl)methylidene]pyrazine-2-carbohydrazide has 1 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 N'-[(E)-(3-nitrophenyl)methylidene]pyrazine-2-carbohydrazide is 1206198-62-0.
The molecular formula of N'-[(E)-(3-nitrophenyl)methylidene]pyrazine-2-carbohydrazide is C12H9N5O3.
The molecular weight of N'-[(E)-(3-nitrophenyl)methylidene]pyrazine-2-carbohydrazide is 271.07053 g/mol.
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