Basic information
- CAS
402482-22-8- Standard SMILES
CCOc1ccccc1-c1cc(C(=O)NN=Cc2cccc(OC)c2O)n[nH]1- InChIKey
QPNMEXLXFSREEO-UHFFFAOYSA-N- Molecular formula
- C20H20N4O4
- Average molar mass
- 380.4 g/mol
- Monoisotopic mass
- 380.14845513
Names & identifiers
- Preferred name
- 3-(2-ethoxyphenyl)-N-[(2-hydroxy-3-methoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
- IUPAC
- 3-(2-ethoxyphenyl)-N-[(2-hydroxy-3-methoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
- English name
- (E)-3-(2-ethoxyphenyl)-N-(2-hydroxy-3-methoxybenzylidene)-1H-pyrazole-5-carbohydrazide
- Molecular formula
- C20H20N4O4
- Molecular weight
- 380.4
Names & synonyms
AKOS0306626203-(2-ethoxyphenyl)-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide3-(2-ETHOXYPHENYL)-N'-(2-HO-3-METHOXYBENZYLIDENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDE3-(2-ETHOXYPHENYL)-N'-(2-HO-3-METHOXYBENZYLIDENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDE(E)-3-(2-ethoxyphenyl)-N-(2-hydroxy-3-methoxybenzylidene)-1H-pyrazole-5-carbohydrazide3-(2-ethoxyphenyl)-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide1H-Pyrazole-3-carboxylic acid, 5-(2-ethoxyphenyl)-, 2-[(2-hydroxy-3-methoxyphenyl)methylene]hydrazide
Database identifiers
- CAS
402482-22-8- PubChem CID
- 1128634
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 532
Physicochemical properties
- Density
- 1.296 · 1.296±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 8.409 · 8.409±0.40(predicted)
Chemistry & industry
Suppliers6 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
OTAVA-BB[email protected]
VITAS-BB—
IFLAB-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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