3-(2-Methoxy-phenyl)-2-thioxo-thiazolidin-4-one
Basic information
- CAS
56676-49-4- Standard SMILES
COc1ccccc1N1C(=O)CSC1=S- InChIKey
AUYJCFFLRJBPCJ-UHFFFAOYSA-N- Molecular formula
- C10H9NO2S2
- Average molar mass
- 239.3 g/mol
- Monoisotopic mass
- 239.00747088
Names & identifiers
- Preferred name
- 3-(2-Methoxy-phenyl)-2-thioxo-thiazolidin-4-one
- IUPAC
- 3-(2-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
- English name
- 3-(2-methoxyphenyl)-2-sulfanylidene-thiazolidin-4-one
- Molecular formula
- C10H9NO2S2
- Molecular weight
- 239.31
Names & synonyms
56676-49-43-(2-Methoxy-phenyl)-2-thioxo-thiazolidin-4-oneDTXSID80303566RefChem:273758DTXCID102546983-(2-Methoxyphenyl)-2-thioxothiazolidin-4-one3-(2-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one3-(2-METHOXYPHENYL)-2-SULFANYLIDENE-THIAZOLIDIN-4-ONE3-(2-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-oneNSC1590913-(2-METHOXYPHENYL)-RHODANINEOprea1_256237
Show more names
4-Thiazolidinone, 3-(2-methoxyphenyl)-2-thioxo-3-(2-Methoxyphenyl)-2-thioxo-4-thiazolidinone, 95%
Oprea1_816501CBDivE_015749MLS001204870CHEMBL1720577HMS2826G17STL417150AKOS000412985NSC-159091
Database identifiers
- CAS
56676-49-4- PubChem CID
- 292895
- DTXSID
DTXSID80303566- ChEMBL
CHEMBL1720577
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 283
Experimental & physicochemical properties
Solubility3.4 [ug/mL] (The mean of the results at pH 7.4)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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