Basic information
- CAS
65201-44-7- Standard SMILES
O=C1C(=CN2CCN(c3ccccc3)CC2)Cc2c(F)cccc21- InChIKey
JVXXCBHIDNMHDO-UHFFFAOYSA-N- Molecular formula
- C20H19FN2O
- Average molar mass
- 322.4 g/mol
- Monoisotopic mass
- 322.1481414
Names & identifiers
- Preferred name
- 1H-Inden-1-one, 2,3-dihydro-4-fluoro-2-((4-phenyl-1-piperazinyl)methylene)-
- IUPAC
- 4-fluoro-2-[(4-phenylpiperazin-1-yl)methylidene]-3H-inden-1-one
Names & synonyms
65201-44-71H-Inden-1-one, 2,3-dihydro-4-fluoro-2-((4-phenyl-1-piperazinyl)methylene)-RefChem:10581112,3-Dihydro-4-fluoro-2-((4-phenyl-1-piperazinyl)methylene)-1H-inden-1-oneBRN 0826491DTXSID601385067NSC 277478
Database identifiers
- CAS
65201-44-7- PubChem CID
- 99945
- DTXSID
DTXSID601385067
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 492
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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