Rhodanine, 5-butyl-3-(p-ethoxyphenyl)-
Basic information
- CAS
23517-75-1- Standard SMILES
CCCCC1SC(=S)N(c2ccc(OCC)cc2)C1=O- InChIKey
WCTHJFQWCCCEMA-UHFFFAOYSA-N- Molecular formula
- C15H19NO2S2
- Average molar mass
- 309.5 g/mol
- Monoisotopic mass
- 309.0857212
Names & identifiers
- Preferred name
- Rhodanine, 5-butyl-3-(p-ethoxyphenyl)-
- IUPAC
- 5-butyl-3-(4-ethoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
23517-75-1Rhodanine, 5-butyl-3-(p-ethoxyphenyl)-RefChem:10980725-Butyl-3-(p-ethoxyphenyl)rhodanine5-butyl-3-(4-ethoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-oneDTXSID80946250
Database identifiers
- CAS
23517-75-1- PubChem CID
- 211700
- DTXSID
DTXSID80946250
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
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Compound notes
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