Cas no 182188-88-1 (4-Thiazolidinone,3-[2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl]-2-(4-nitrophenyl)-)

4-Thiazolidinone,3-[2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl]-2-(4-nitrophenyl)- structure
182188-88-1 structure
Product Name:4-Thiazolidinone,3-[2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl]-2-(4-nitrophenyl)-
CAS No:182188-88-1
MF:C22H25N3O4S
MW:427.516604185104
CID:146209
PubChem ID:3075456
Update Time:2025-04-19

4-Thiazolidinone,3-[2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl]-2-(4-nitrophenyl)- Chemical and Physical Properties

Names and Identifiers

    • 4-Thiazolidinone,3-[2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl]-2-(4-nitrophenyl)-
    • 3-[2-(4-hydroxy-4-phenylpiperidin-1-yl)ethyl]-2-(4-nitrophenyl)-1,3-thiazolidin-4-one
    • 3-(2-(4-Hydroxy-4-phenyl-1-piperidinyl)ethyl)-2-(4-nitrophenyl)-4-thiazolidinone
    • 4-Thiazolidinone, 3-(2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl)-2-(4-nitrophenyl)-
    • 3-[2-(4-hydroxy-4-phenyl-1-piperidyl)ethyl]-2-(4-nitrophenyl)thiazolid in-4-one
    • 182188-88-1
    • DTXSID50939533
    • Inchi: 1S/C22H25N3O4S/c26-20-16-30-21(17-6-8-19(9-7-17)25(28)29)24(20)15-14-23-12-10-22(27,11-13-23)18-4-2-1-3-5-18/h1-9,21,27H,10-16H2
    • InChI Key: XDEWPWGNMSOAKL-UHFFFAOYSA-N
    • SMILES: S1CC(N(C1C1C=CC(=CC=1)[N+](=O)[O-])CCN1CCC(C2C=CC=CC=2)(CC1)O)=O

Computed Properties

  • Exact Mass: 427.15675
  • Monoisotopic Mass: 427.157
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 5
  • Complexity: 606
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: 2.8
  • Topological Polar Surface Area: 115?2

Experimental Properties

  • Density: 1.325
  • Boiling Point: 680.1°Cat760mmHg
  • Flash Point: 365.1°C
  • Refractive Index: 1.642
  • PSA: 86.92

4-Thiazolidinone,3-[2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl]-2-(4-nitrophenyl)- Related Literature

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