5-(4-Benzyloxy-PH)-2H-pyrazole-3-carboxylic acid (4-CL-benzylidene)-hydrazide
Basic information
- CAS
634886-80-9- Standard SMILES
O=C(N/N=C/c1ccc(Cl)cc1)c1cc(-c2ccc(OCc3ccccc3)cc2)n[nH]1- InChIKey
BIVQBXSAHNENEK-CVKSISIWSA-N- Molecular formula
- C24H19ClN4O2
- Average molar mass
- 430.9 g/mol
- Monoisotopic mass
- 430.1196536
Names & identifiers
- Preferred name
- 5-(4-Benzyloxy-PH)-2H-pyrazole-3-carboxylic acid (4-CL-benzylidene)-hydrazide
- IUPAC
- N-[(E)-(4-chlorophenyl)methylideneamino]-3-(4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide
Names & synonyms
AKOS0244219345-(4-BENZYLOXY-PH)-2H-PYRAZOLE-3-CARBOXYLIC ACID (4-CL-BENZYLIDENE)-HYDRAZIDE
Database identifiers
- CAS
634886-80-9- PubChem CID
- 9605550
- EC Number
- 162-876-1
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 582
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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