Basic information
- CAS
4055-33-8- Standard SMILES
COc1ccc(OCCN2C(=O)CSC2c2cc(OC)c(OC)c(OC)c2)cc1- InChIKey
AUIYBGDQPHXMFS-UHFFFAOYSA-N- Molecular formula
- C21H25NO6S
- Average molar mass
- 419.5 g/mol
- Monoisotopic mass
- 419.14025869
Names & identifiers
- Preferred name
- 3-[2-(4-Methoxyphenoxy)ethyl]-2-(3,4,5-trimethoxyphenyl)-1,3-thiazolidin-4-one
- IUPAC
- 3-[2-(4-methoxyphenoxy)ethyl]-2-(3,4,5-trimethoxyphenyl)-1,3-thiazolidin-4-one
Names & synonyms
4055-33-83-[2-(4-methoxyphenoxy)ethyl]-2-(3,4,5-trimethoxyphenyl)-1,3-thiazolidin-4-oneDTXSID80410961
Database identifiers
- CAS
4055-33-8- PubChem CID
- 5220172
- DTXSID
DTXSID80410961
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 91.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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