Basic information
- Standard SMILES
CCCCCCOc1ccc(C(=O)Nc2ccccc2Sc2ccccc2C#N)cc1- InChIKey
ZSUQKDYNDJDRRM-UHFFFAOYSA-N- Molecular formula
- C26H26N2O2S
- Average molar mass
- 430.6 g/mol
Names & identifiers
- Preferred name
- N-[2-(2-cyanophenylthio)phenyl]-4-hexyloxybenzamide
- IUPAC
- N-[2-(2-cyanophenyl)sulfanylphenyl]-4-hexoxybenzamide
Names & synonyms
SCHEMBL9130744ZSUQKDYNDJDRRM-UHFFFAOYSA-NN-[2-(2-cyanophenylthio)phenyl]-4-hexyloxybenzamide
Database identifiers
- PubChem CID
- 20084446
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 87.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 581
Related reactions
2 records
Compound notes
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