Cas no 61815-24-5 (4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo-)

4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo- structure
61815-24-5 structure
Product Name:4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo-
CAS No:61815-24-5
MF:C12H14N2OS
MW:234.317361354828
CID:465415
PubChem ID:71391922
Update Time:2025-04-19

4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo- Chemical and Physical Properties

Names and Identifiers

    • 4-Imidazolidinone, 5-ethyl-5-methyl-3-phenyl-2-thioxo-
    • 5-ethyl-5-methyl-3-phenyl-2-sulfanylideneimidazolidin-4-one
    • 61815-24-5
    • 5-Ethyl-5-methyl-3-phenyl-2-thioxoimidazolidin-4-one
    • DTXSID70813745
    • Inchi: 1S/C12H14N2OS/c1-3-12(2)10(15)14(11(16)13-12)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,13,16)
    • InChI Key: MZYLEMCWTXNZPU-UHFFFAOYSA-N
    • SMILES: S=C1N(C2C=CC=CC=2)C(C(C)(CC)N1)=O

Computed Properties

  • Exact Mass: 234.08282
  • Monoisotopic Mass: 234.08268425g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 312
  • 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
  • XLogP3: 2.4
  • Topological Polar Surface Area: 64.4?2

Experimental Properties

  • PSA: 32.34
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