Ketone, beta-(p-chlorophenyl)phenethyl 4-(o-chlorophenyl)piperazinyl
Basic information
- CAS
25174-66-7- Standard SMILES
O=C(CC(c1ccccc1)c1ccc(Cl)cc1)N1CCN(c2ccccc2Cl)CC1- InChIKey
QNMUVPCRPKARFA-UHFFFAOYSA-N- Molecular formula
- C25H24Cl2N2O
- Average molar mass
- 439.4 g/mol
- Monoisotopic mass
- 438.1265688
Names & identifiers
- Preferred name
- Ketone, beta-(p-chlorophenyl)phenethyl 4-(o-chlorophenyl)piperazinyl
- IUPAC
- 3-(4-chlorophenyl)-1-[4-(2-chlorophenyl)piperazin-1-yl]-3-phenylpropan-1-one
- English name
- 1-[4-(o-Chlorophenyl)-1-piperazinyl]-3-(p-chlorophenyl)-3-phenyl-1-propanone
- Molecular formula
- C25H24Cl2N2O
- Molecular weight
- 439.38
Names & synonyms
beta-(p-Chlorophenyl)phenethyl 4-(o-chlorophenyl)piperazinyl ketone25174-66-71-(o-Chlorophenyl)-4-(3-(p-chlorophenyl)-3-phenylpropionyl)piperazineKETONE, beta-(p-CHLOROPHENYL)PHENETHYL 4-(o-CHLOROPHENYL)PIPERAZINYLPiperazine, 1-(o-chlorophenyl)-4-(3-(p-chlorophenyl)-3-phenylpropionyl)-RefChem:3504483-(4-chlorophenyl)-1-[4-(2-chlorophenyl)piperazin-1-yl]-3-phenylpropan-1-oneDTXSID609480301-[4-(o-Chlorophenyl)-1-piperazinyl]-3-(p-chlorophenyl)-3-phenyl-1-propanone1-Propanone, 3-(4-chlorophenyl)-1-[4-(2-chlorophenyl)-1-piperazinyl]-3-phenyl-
Database identifiers
- CAS
25174-66-7- PubChem CID
- 32828
- DTXSID
DTXSID60948030- Nikkaji
- J41.531F
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 537
Physicochemical properties
- Density
- 1.2434 · 1.2434 (rough estimate)
- refractive index
- 1.549 · 1.5490 (estimate)
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Compound notes
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