Basic information
- Standard SMILES
CCCOc1ccc(-c2nc(-c3cccc4[nH]ccc34)no2)cc1OCCC- InChIKey
YVPYLPGOHBYCKN-UHFFFAOYSA-N- Molecular formula
- C22H23N3O3
- Average molar mass
- 377.4 g/mol
Names & identifiers
- Preferred name
- 5-(3,4-dipropoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole
- IUPAC
- 5-(3,4-dipropoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole
Names & synonyms
SCHEMBL564999YVPYLPGOHBYCKN-UHFFFAOYSA-N5-(3,4-dipropoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole
Database identifiers
- PubChem CID
- 66726263
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 73.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 480
Related reactions
2 records
Compound notes
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