Cas no 14960-95-3 (Piperazine, 1-(4-nitrophenyl)-4-phenyl-)

Piperazine, 1-(4-nitrophenyl)-4-phenyl- structure
14960-95-3 structure
Product Name:Piperazine, 1-(4-nitrophenyl)-4-phenyl-
CAS No:14960-95-3
MF:C16H17N3O2
MW:283.325083494186
CID:1321525
PubChem ID:4011831
Update Time:2025-04-20

Piperazine, 1-(4-nitrophenyl)-4-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Piperazine, 1-(4-nitrophenyl)-4-phenyl-
    • 1-(4-nitrophenyl)-4-phenylpiperazine
    • SCHEMBL12952781
    • DTXSID40398519
    • 1-(4-nitrophenyl)-4-phenyl-piperazine
    • 4,4'-(N-phenyl-1-piperazinyl)-nitrobenzene
    • HMS2833N07
    • SR-01000812755-2
    • MLS001183678
    • Z31199331
    • STK125927
    • AKOS005062955
    • SR-01000812755
    • CHEMBL1333089
    • 14960-95-3
    • SMR000502845
    • Inchi: 1S/C16H17N3O2/c20-19(21)16-8-6-15(7-9-16)18-12-10-17(11-13-18)14-4-2-1-3-5-14/h1-9H,10-13H2
    • InChI Key: YZFKJWVCVQXRMB-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1C=CC(=CC=1)N1CCN(C2C=CC=CC=2)CC1)=O

Computed Properties

  • Exact Mass: 283.13221
  • Monoisotopic Mass: 283.132
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 2
  • Complexity: 336
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.5
  • Topological Polar Surface Area: 52.3?2

Experimental Properties

  • PSA: 49.62
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