Basic information
- CAS
27338-62-1- Standard SMILES
CC(CCN1CCN(c2ccc(F)cc2)CC1)NC(=O)c1ccc(Cl)cc1- InChIKey
DWHRYXOFXGGWJE-UHFFFAOYSA-N- Molecular formula
- C21H25ClFN3O
- Average molar mass
- 389.9 g/mol
- Monoisotopic mass
- 389.1670183
Names & identifiers
- Preferred name
- Benzamide, p-chloro-N-(3-(4-(p-fluorophenyl)-1-piperazinyl)-1-methylpropyl)-
- IUPAC
- 4-chloro-N-[4-[4-(4-fluorophenyl)piperazin-1-yl]butan-2-yl]benzamide
- English name
- p-Chloro-N-[3-[4-(p-fluorophenyl)-1-piperazinyl]-1-methylpropyl]benzamide
- Molecular formula
- C21H25ClFN3O
- Molecular weight
- 389.89
Names & synonyms
27338-62-1BRN 0849076p-Chloro-N-(3-(4-(p-fluorophenyl)-1-piperazinyl)-1-methylpropyl)benzamide1-(4-Fluorophenyl)-4-(3-(4-chlorobenzoyl)amino)butylpiperazine5-23-01-00362 (Beilstein Handbook Reference)BENZAMIDE, p-CHLORO-N-(3-(4-(p-FLUOROPHENYL)-1-PIPERAZINYL)-1-METHYLPROPYL)-RefChem:3225954-Chloro-N-[3-[4-(4-Fluorophenyl)-1-Piperazinyl]-1-Methylpropyl]Benzamide4-chloro-N-[4-[4-(4-fluorophenyl)piperazin-1-yl]butan-2-yl]benzamide4-Chloro-N-{4-[4-(4-fluorophenyl)piperazin-1-yl]butan-2-yl}benzamideDTXSID00950051p-Chloro-N-[3-[4-(p-fluorophenyl)-1-piperazinyl]-1-methylpropyl]benzamide
Show more names
Benzamide, 4-chloro-N-[3-[4-(4-fluorophenyl)-1-piperazinyl]-1-methylpropyl]-
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 456
Physicochemical properties
- Boiling point
- 566.2 · 566.2±50.0 °C(Predicted)
- Density
- 1.201 · 1.201±0.06 g/cm3(Predicted)
- pka
- 14.13 · 14.13±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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