Basic information
- Standard SMILES
CC(NC(=O)C=Cc1ccccc1F)c1cccc(-c2nccs2)c1- InChIKey
GLBKDBLPBVBZOX-UHFFFAOYSA-N- Molecular formula
- C20H17FN2OS
- Average molar mass
- 352.4 g/mol
- Monoisotopic mass
- 352.10456251
Names & identifiers
- Preferred name
- 3-(2-fluorophenyl)-N-[1-[3-(1,3-thiazol-2-yl)phenyl]ethyl]prop-2-enamide
- IUPAC
- 3-(2-fluorophenyl)-N-[1-[3-(1,3-thiazol-2-yl)phenyl]ethyl]prop-2-enamide
Names & synonyms
SCHEMBL5215987
Database identifiers
- PubChem CID
- 69356012
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 473
Related reactions
1 records
Compound notes
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