5-[[3-Ethoxy-4-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]phenyl]methylene]-3-(2-propen-1-yl)-2-thioxo-4-thiazolidinone
Basic information
- CAS
300390-94-7- Standard SMILES
C=CCN1C(=O)C(=Cc2ccc(OCCOCCOc3ccc(C)cc3)c(OCC)c2)SC1=S- InChIKey
SULWVDXGOMUBBB-UHFFFAOYSA-N- Molecular formula
- C26H29NO5S2
- Average molar mass
- 499.6 g/mol
- Monoisotopic mass
- 499.14871537
Names & identifiers
- Preferred name
- 5-[[3-Ethoxy-4-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]phenyl]methylene]-3-(2-propen-1-yl)-2-thioxo-4-thiazolidinone
- IUPAC
- 5-[[3-ethoxy-4-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]phenyl]methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
DTXSID501107288300390-94-75-[[3-Ethoxy-4-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]phenyl]methylene]-3-(2-propen-1-yl)-2-thioxo-4-thiazolidinone5-[(3-ETHOXY-4-{2-[2-(4-METHYLPHENOXY)ETHOXY]ETHOXY}PHENYL)METHYLIDENE]-3-(PROP-2-EN-1-YL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE
Database identifiers
- CAS
300390-94-7- PubChem CID
- 3901900
- DTXSID
DTXSID501107288
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 13
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 707
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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