Basic information
- Standard SMILES
CCCCCCOc1ccc(C(=O)Nc2ccccc2Oc2ccccc2C#N)cc1- InChIKey
FIGPTPPYISZWHN-UHFFFAOYSA-N- Molecular formula
- C26H26N2O3
- Average molar mass
- 414.5 g/mol
- Monoisotopic mass
- 414.1943427
Names & identifiers
- Preferred name
- N-[2-[2-Cyanophenoxy]phenyl]-4-hexyloxybenzamide
- IUPAC
- N-[2-(2-cyanophenoxy)phenyl]-4-hexoxybenzamide
Names & synonyms
SCHEMBL9129427FIGPTPPYISZWHN-UHFFFAOYSA-NN-[2-[2-Cyanophenoxy]phenyl]-4-hexyloxybenzamide
Database identifiers
- PubChem CID
- 20084541
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 71.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 578
Related reactions
2 records
Compound notes
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