Basic information
- Standard SMILES
CC(C)=Cc1ccc(N2CC(=O)NS2(=O)=O)c(OCc2ccccc2)c1- InChIKey
WBBYBOQLVGMXJV-UHFFFAOYSA-N- Molecular formula
- C19H20N2O4S
- Average molar mass
- 372.4 g/mol
Names & identifiers
- Preferred name
- 5-[2-Benzyloxy-4-(2-methylpropenyl)-phenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
- IUPAC
- 5-[4-(2-methylprop-1-enyl)-2-phenylmethoxyphenyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one
Names & synonyms
SCHEMBL3921999WBBYBOQLVGMXJV-UHFFFAOYSA-N5-[2-Benzyloxy-4-(2-methylpropenyl)-phenyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
Database identifiers
- PubChem CID
- 68840459
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 84.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 630
Related reactions
1 records
Compound notes
Loading…