Basic information
- Standard SMILES
CC(C)(C)c1cc(CC2SC(=S)NC2=O)cc(C(C)(C)C)c1O- InChIKey
PWRGVTODAPJEIP-UHFFFAOYSA-N- Molecular formula
- C18H25NO2S2
- Average molar mass
- 351.5 g/mol
Names & identifiers
- Preferred name
- 5-[[3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-2-thioxo-4-thiazolidinone
- IUPAC
- 5-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-2-thioxo-4-thiazolidinone5-{[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl}-2-thioxo-4-thiazolidinoneSCHEMBL7561578PWRGVTODAPJEIP-UHFFFAOYSA-N5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-2-thioxo -4-thiazolidinone
Database identifiers
- PubChem CID
- 9968356
- Nikkaji
- J1.344.009C
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 454
Related reactions
14 records
Linked notes
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