Basic information
- Standard SMILES
N#Cc1c(-c2ccc(Oc3ccccc3)cc2)[nH]c(-c2cccc(Br)c2)cc1=O- InChIKey
CUCLETIUOWBVFI-UHFFFAOYSA-N- Molecular formula
- C24H15BrN2O2
- Average molar mass
- 443.3 g/mol
Names & identifiers
- Preferred name
- 6-(3-Bromophenyl)-4-hydroxy-2-(4-phenoxyphenyl)nicotinonitrile
- IUPAC
- 6-(3-bromophenyl)-4-oxo-2-(4-phenoxyphenyl)-1H-pyridine-3-carbonitrile
Names & synonyms
SCHEMBL1162787SCHEMBL1163432CUCLETIUOWBVFI-UHFFFAOYSA-N6-(3-bromophenyl)-4-hydroxy-2-(4-phenoxyphenyl)nicotinonitrile6-(3-bromophenyl)-4-oxo-2-(4-phenoxyphenyl)-1,4-dihydropyridine-3-carbonitrile
Database identifiers
- PubChem CID
- 66926935
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 62.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 720
Related reactions
1 records
Compound notes
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