5-(4-Propylphenyl)-3-(1,2,3,4-tetrahydroquinolin-5-yl)-1,2,4-oxadiazole
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Basic information
- Standard SMILES
CCCc1ccc(-c2nc(-c3cccc4c3CCCN4)no2)cc1- InChIKey
DBCXVBDSXQBTGI-UHFFFAOYSA-N- Molecular formula
- C20H21N3O
- Average molar mass
- 319.4 g/mol
- Monoisotopic mass
- 319.1684623
Names & identifiers
- Preferred name
- 5-(4-Propylphenyl)-3-(1,2,3,4-tetrahydroquinolin-5-yl)-1,2,4-oxadiazole
- IUPAC
- 5-(4-propylphenyl)-3-(1,2,3,4-tetrahydroquinolin-5-yl)-1,2,4-oxadiazole
Names & synonyms
SCHEMBL565238DBCXVBDSXQBTGI-UHFFFAOYSA-N5-(4-propylphenyl)-3-(1,2,3,4-tetrahydroquinolin-5-yl)-1,2,4-oxadiazole
Database identifiers
- PubChem CID
- 66726348
Properties
Computed structural propertiesFilling in
- XLogP
- 5.2
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 396
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Related reactions
2 records
Compound notes
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