Basic information
- Standard SMILES
FC(F)(F)c1ccc2c(N3CCNCC3)csc2c1- InChIKey
VKEGOEYINSYJPL-UHFFFAOYSA-N- Molecular formula
- C13H13F3N2S
- Average molar mass
- 286.32 g/mol
Names & identifiers
- Preferred name
- 1-(6-Trifluoromethyl-benzo[b]thiophen-3-yl)-piperazine
- IUPAC
- 1-[6-(trifluoromethyl)-1-benzothiophen-3-yl]piperazine
Names & synonyms
1-(6-trifluoromethyl-benzo[b]thiophen-3-yl)-piperazineSCHEMBL2966925
Database identifiers
- PubChem CID
- 11289155
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 43.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 318
Related reactions
8 records
Compound notes
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