N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-3-phenyl-1H-pyrazole-5-carbohydrazide
Basic information
- CAS
305354-08-9- Standard SMILES
COc1ccc(/C=N/NC(=O)c2cc(-c3ccccc3)n[nH]2)cc1OC- InChIKey
QDLVSRULPVBIOB-UDWIEESQSA-N- Molecular formula
- C19H18N4O3
- Average molar mass
- 350.4 g/mol
- Monoisotopic mass
- 350.13789045
Names & identifiers
- Preferred name
- N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-3-phenyl-1H-pyrazole-5-carbohydrazide
- IUPAC
- N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-3-phenyl-1H-pyrazole-5-carboxamide
- English name
- N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-3-phenyl-1H-pyrazole-5-carbohydrazide
- Molecular formula
- C19H18N4O3
- Molecular weight
- 350.37
Names & synonyms
STK1914055-Phenyl-2H-pyrazole-3-carboxylic acid (3,4-dimethoxy-benzylidene)-hydrazideAKOS000545573ST50236813Z44859219N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-3-phenyl-1H-pyrazole-5-carbohydrazideN-[(1E)-2-(3,4-dimethoxyphenyl)-1-azavinyl](3-phenylpyrazol-5-yl)carboxamide
Database identifiers
- CAS
305354-08-9- PubChem CID
- 6900341
- EC Number
- 153-050-1
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 88.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 481
Physicochemical properties
- Density
- 1.25 · 1.250±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.043 · 11.043±0.46(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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