Basic information
- CAS
6035-29-6- Standard SMILES
CC(=O)N1CCN(c2ccc(C(=O)c3cccc(F)c3)cc2)CC1- InChIKey
KGQFMUQTBDWCKY-UHFFFAOYSA-N- Molecular formula
- C19H19FN2O2
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.14305602
Names & identifiers
- Preferred name
- [4-(4-Acetyl-1-piperazinyl)phenyl](3-fluorophenyl)methanone
- IUPAC
- 1-[4-[4-(3-fluorobenzoyl)phenyl]piperazin-1-yl]ethanone
Names & synonyms
6035-29-6[4-(4-acetyl-1-piperazinyl)phenyl](3-fluorophenyl)methanoneCBMicro_041843Oprea1_372518Oprea1_642652DTXSID509757591-{4-[4-(3-Fluorobenzoyl)phenyl]piperazin-1-yl}ethan-1-oneAKOS000596593BIM-0041640.P001SR-01000462243SR-01000462243-1
Database identifiers
- CAS
6035-29-6- PubChem CID
- 712883
- DTXSID
DTXSID50975759
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 454
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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