Rhodanine, 5-ethyl-3-phenyl-
Basic information
- CAS
1986-34-1- Standard SMILES
CCC1SC(=S)N(c2ccccc2)C1=O- InChIKey
KEAFRGDNAUXCLN-UHFFFAOYSA-N- Molecular formula
- C11H11NOS2
- Average molar mass
- 237.3 g/mol
- Monoisotopic mass
- 237.02820632
Names & identifiers
- Preferred name
- Rhodanine, 5-ethyl-3-phenyl-
- IUPAC
- 5-ethyl-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
Rhodanine, 5-ethyl-3-phenyl-1986-34-1RefChem:10980785-Ethyl-3-phenylrhodanineNSC 32131BRN 0190350NSC32131DTXSID501384935NSC-32131
Database identifiers
- CAS
1986-34-1- PubChem CID
- 97728
- DTXSID
DTXSID501384935
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 274
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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