5-Butyl-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Basic information
- CAS
23522-16-9- Standard SMILES
CCCCC1SC(=S)N(C(C)c2ccccc2)C1=O- InChIKey
JYYQBQLDJQFEIR-UHFFFAOYSA-N- Molecular formula
- C15H19NOS2
- Average molar mass
- 293.5 g/mol
- Monoisotopic mass
- 293.09080658
Names & identifiers
- Preferred name
- 5-Butyl-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
- IUPAC
- 5-butyl-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
23522-16-95-butyl-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-oneDTXSID20946259RefChem:1072753DTXCID6013745495-Butyl-3-(alpha-methylbenzyl)rhodanineRhodanine, 5-butyl-3-(alpha-methylbenzyl)-
Database identifiers
- CAS
23522-16-9- PubChem CID
- 211708
- DTXSID
DTXSID20946259
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 339
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…