Basic information
- CAS
403658-76-4- Standard SMILES
CCOc1ccccc1-c1cc(C(=O)N/N=C/c2ccc(F)cc2)[nH]n1- InChIKey
CLEGKOASVQZTLM-CIAFOILYSA-N- Molecular formula
- C19H17FN4O2
- Average molar mass
- 352.4 g/mol
- Monoisotopic mass
- 352.13355396
Names & identifiers
- Preferred name
- 3-(2-Ethoxyphenyl)-N'-(4-fluorobenzylidene)-1H-pyrazole-5-carbohydrazide
- IUPAC
- 3-(2-ethoxyphenyl)-N-[(E)-(4-fluorophenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Names & synonyms
STK108407AKOS000561628ST021488(E)-3-(2-ethoxyphenyl)-N'-(4-fluorobenzylidene)-1H-pyrazole-5-carbohydrazide3-(2-ETHOXYPHENYL)-N'-(4-FLUOROBENZYLIDENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDEN-[(1E)-2-(4-fluorophenyl)-1-azavinyl][3-(2-ethoxyphenyl)pyrazol-5-yl]carboxam ide
Database identifiers
- CAS
403658-76-4- PubChem CID
- 6867697
- EC Number
- 140-607-9
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 482
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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