Thiazolidine, 2-((2-hydroxyphenoxy)methyl)-3-((methylthio)acetyl)-
Basic information
- CAS
161364-48-3- Standard SMILES
CSCC(=O)N1CCSC1COc1ccccc1O- InChIKey
DHWWSZKPGBDKMU-UHFFFAOYSA-N- Molecular formula
- C13H17NO3S2
- Average molar mass
- 299.4 g/mol
- Monoisotopic mass
- 299.06498575
Names & identifiers
- Preferred name
- Thiazolidine, 2-((2-hydroxyphenoxy)methyl)-3-((methylthio)acetyl)-
- IUPAC
- 1-[2-[(2-hydroxyphenoxy)methyl]-1,3-thiazolidin-3-yl]-2-methylsulfanylethanone
Names & synonyms
2-((2-Hydroxyphenoxy)methyl)-3-((methylthio)acetyl)thiazolidine161364-48-3Thiazolidine, 2-((2-hydroxyphenoxy)methyl)-3-((methylthio)acetyl)-2-((2-Hydroxyphenoxy)methyl)-3-(2-(methylthio)acetyl)-1,3-thiazolidineRefChem:384623CHEMBL149951DTXSID009364911-{2-[(2-Hydroxyphenoxy)methyl]-1,3-thiazolidin-3-yl}-2-(methylsulfanyl)ethan-1-one
Database identifiers
- CAS
161364-48-3- PubChem CID
- 3074740
- DTXSID
DTXSID00936491- ChEMBL
CHEMBL149951
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 304
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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