Basic information
- Standard SMILES
CC(COc1ccc(CC2SC(=O)NC2=O)cc1)NCC(O)Cc1ccccc1- InChIKey
PEZGQKJADSOFGD-UHFFFAOYSA-N- Molecular formula
- C22H26N2O4S
- Average molar mass
- 414.5 g/mol
Names & identifiers
- Preferred name
- 5-{4-[2-(3-Phenyl-2-hydroxypropylamino)propoxy]benzyl}thiazolidine-2,4-dione
- IUPAC
- 5-[[4-[2-[(2-hydroxy-3-phenylpropyl)amino]propoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Names & synonyms
SCHEMBL8974649PEZGQKJADSOFGD-UHFFFAOYSA-N5-{4-[2-(3-Phenyl-2-hydroxypropylamino)propoxy]-benzyl}thiazolidine-2,4-dione5-{4-[2-(3-Phenyl-2-hydroxypropylamino)propoxy]benzyl}thiazolidine-2,4-dione
Database identifiers
- PubChem CID
- 9801907
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 533
Related reactions
6 records
Compound notes
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