(5R)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-1,3-thiazolidin-4-one
Basic information
- CAS
136433-33-5- Standard SMILES
CC(C)(C)c1cc(C[C@H]2SCNC2=O)cc(C(C)(C)C)c1O- InChIKey
ILMMRHUILQOQGP-CQSZACIVSA-N- Molecular formula
- C18H27NO2S
- Average molar mass
- 321.5 g/mol
- Monoisotopic mass
- 321.17625028
Names & identifiers
- Preferred name
- (5R)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-1,3-thiazolidin-4-one
- IUPAC
- (5R)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-1,3-thiazolidin-4-one
Names & synonyms
Tazofelone, (R)-JUM3PW8GJUSCHEMBL7561505(5R)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-1,3-thiazolidin-4-oneLY 231697LY-231697(5R)-5-[[3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-4-thiazolidinone4-Thiazolidinone, 5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, (5R)-4-Thiazolidinone, 5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, (R)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-1,3-thiazolidin-4-one, (5R)-5-[[3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-4-thiazolidinone, (5R)-136433-33-5
Database identifiers
- CAS
136433-33-5- PubChem CID
- 643569
- UNII
- JUM3PW8GJU
- Nikkaji
- J872.183A
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 386
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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