Basic information
- Standard SMILES
Nc1nonc1-c1nc2ccccc2n1CC(=O)C=Cc1ccccc1- InChIKey
PAJVEASDTVBAOP-UHFFFAOYSA-N- Molecular formula
- C19H15N5O2
- Average molar mass
- 345.4 g/mol
- Monoisotopic mass
- 345.12257474
Names & identifiers
- Preferred name
- 1-[2-(4-Amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-4-phenylbut-3-en-2-one
- IUPAC
- 1-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-4-phenylbut-3-en-2-one
Names & synonyms
SCHEMBL2578778
Database identifiers
- PubChem CID
- 67460341
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 99.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 522
Related reactions
1 records
Compound notes
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