4-Thiazolidinone, 5-((4-hydroxy-3-methoxyphenyl)methylene)-3-((phenylamino)methyl)-2-thioxo-
Basic information
- CAS
89752-50-1- Standard SMILES
COc1cc(/C=C2/SC(=S)N(CNc3ccccc3)C2=O)ccc1O- InChIKey
BCAMQDKEFHPGHZ-MHWRWJLKSA-N- Molecular formula
- C18H16N2O3S2
- Average molar mass
- 372.5 g/mol
- Monoisotopic mass
- 372.06023472
Names & identifiers
- Preferred name
- 4-Thiazolidinone, 5-((4-hydroxy-3-methoxyphenyl)methylene)-3-((phenylamino)methyl)-2-thioxo-
- IUPAC
- (5E)-3-(anilinomethyl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
4-Thiazolidinone, 5-((4-hydroxy-3-methoxyphenyl)methylene)-3-((phenylamino)methyl)-2-thioxo-89752-50-1RefChem:10716995-((4-Hydroxy-3-methoxyphenyl)methylene)-3-((phenylamino)methyl)-2-thioxo-4-thiazolidinone
Database identifiers
- CAS
89752-50-1- PubChem CID
- 6366171
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 534
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…