4-(2-Oxo-pyrrolidin-1-yl)-benzoic acid (1-phenyl-propylidene)-hydrazide
Basic information
- CAS
5248-71-5- Standard SMILES
CC/C(=N\NC(=O)c1ccc(N2CCCC2=O)cc1)c1ccccc1- InChIKey
VZNCFTWWLBCRDV-DYTRJAOYSA-N- Molecular formula
- C20H21N3O2
- Average molar mass
- 335.4 g/mol
- Monoisotopic mass
- 335.16337692
Names & identifiers
- Preferred name
- 4-(2-Oxo-pyrrolidin-1-yl)-benzoic acid (1-phenyl-propylidene)-hydrazide
- IUPAC
- 4-(2-oxopyrrolidin-1-yl)-N-[(E)-1-phenylpropylideneamino]benzamide
Names & synonyms
5248-71-54-(2-Oxo-pyrrolidin-1-yl)-benzoic acid (1-phenyl-propylidene)-hydrazideDTXSID40416247RefChem:287385DTXCID703670964-(2-oxopyrrolidin-1-yl)-N-[(E)-1-phenylpropylideneamino]benzamide4-(2-oxo-1-pyrrolidinyl)-N'-(1-phenylpropylidene)benzohydrazideMLS001222705CHEMBL1966404AKOS000668444SMR000607701ST50225048
Show more names
N-((1E)-2-phenyl-1-azabut-1-enyl)[4-(2-oxopyrrolidinyl)phenyl]carboxamide4-(2-OXOPYRROLIDIN-1-YL)-N'-[(1E)-1-PHENYLPROPYLIDENE]BENZOHYDRAZIDE
Database identifiers
- CAS
5248-71-5- PubChem CID
- 5331395
- DTXSID
DTXSID40416247- ChEMBL
CHEMBL1966404
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 503
Experimental & physicochemical properties
Solubility15 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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