5-[[3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-2-thioxo-4-thiazolidinone

HCID 9968356

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

Related reactions

14 records

Linked notes

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