Thiazolidine, 2-((2-methoxyphenoxy)methyl)-3-((methylsulfinyl)acetyl)-, 1-oxide
Basic information
- CAS
161364-49-4- Standard SMILES
COc1ccccc1OCC1N(C(=O)CS(C)=O)CCS1=O- InChIKey
IYIWYGYJTBWFFC-UHFFFAOYSA-N- Molecular formula
- C14H19NO5S2
- Average molar mass
- 345.4 g/mol
- Monoisotopic mass
- 345.07046505
Names & identifiers
- Preferred name
- Thiazolidine, 2-((2-methoxyphenoxy)methyl)-3-((methylsulfinyl)acetyl)-, 1-oxide
- IUPAC
- 1-[2-[(2-methoxyphenoxy)methyl]-1-oxo-1,3-thiazolidin-3-yl]-2-methylsulfinylethanone
Names & synonyms
161364-49-42-((2-Methoxyphenoxy)methyl)-3-((methylsulfinyl)acetyl)thiazolidine 1-oxideThiazolidine, 2-((2-methoxyphenoxy)methyl)-3-((methylsulfinyl)acetyl)-, 1-oxide2-((2-Methoxyphenoxy)methyl)-3-(2-(methylsulfinyl)acetyl)-1,3-thiazolidine 1-oxideRefChem:384626CHEMBL348206DTXSID609364923-[(Methanesulfinyl)acetyl]-2-[(2-methoxyphenoxy)methyl]-1lambda~4~,3-thiazolidin-1-one
Database identifiers
- CAS
161364-49-4- PubChem CID
- 3074741
- DTXSID
DTXSID60936492- ChEMBL
CHEMBL348206
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 445
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…