(4-(4-Fluorophenyl)-1-piperazinyl)phenylmethanethione
Basic information
- CAS
451487-21-1- Standard SMILES
Fc1ccc(N2CCN(C(=S)c3ccccc3)CC2)cc1- InChIKey
IXGABNNKNIMUSD-UHFFFAOYSA-N- Molecular formula
- C17H17FN2S
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.10964789
Names & identifiers
- Preferred name
- (4-(4-Fluorophenyl)-1-piperazinyl)phenylmethanethione
- IUPAC
- [4-(4-fluorophenyl)piperazin-1-yl]-phenylmethanethione
Names & synonyms
451487-21-1[4-(4-Fluorophenyl)-1-piperazinyl]phenylmethanethione(4-(4-Fluorophenyl)-1-piperazinyl)phenylmethanethioneRefChem:208496[4-(4-fluorophenyl)piperazin-1-yl](phenyl)methanethione(4-(4-fluorophenyl)piperazin-1-yl)(phenyl)methanethioneOprea1_664454DTXSID001213412STL363820AKOS000348390
Database identifiers
- CAS
451487-21-1- PubChem CID
- 934064
- DTXSID
DTXSID001213412
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 38.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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