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Home > Encyclopedia > 5-methyl-4-(4-nitrophenyl)sulfanyl-2-phenyl-1H-pyrazol-3-one

5-methyl-4-(4-nitrophenyl)sulfanyl-2-phenyl-1H-pyrazol-3-one

5-methyl-4-(4-nitrophenyl)sulfanyl-2-phenyl-1H-pyrazol-3-one structure

5-methyl-4-(4-nitrophenyl)sulfanyl-2-phenyl-1H-pyrazol-3-one 

structure
  • CAS No:

    78576-05-3

  • Formula:

    C16H13N3O3S

  • Chemical Name:

    5-methyl-4-(4-nitrophenyl)sulfanyl-2-phenyl-1H-pyrazol-3-one

  • Synonyms:

    ZINC102131083;MCULE-9691170275;Z56762801;3-methyl-4-[(4-nitrophenyl)sulfanyl]-1-phenyl-1H-pyrazol-5-ol;78576-05-3

5-methyl-4-(4-nitrophenyl)sulfanyl-2-phenyl-1H-pyrazol-3-one Basic Attributes

327.4 g/mol

327.06776246 g/mol

Characteristics

104 Ų

4.4689

237 - 240 °C (propan-2-ol)

Computed Properties

Molecular Weight:327.4
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:327.06776246
Monoisotopic Mass:327.06776246
Topological Polar Surface Area:104
Heavy Atom Count:23
Complexity:503
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 5-methyl-4-(4-nitrophenyl)sulfanyl-2-phenyl-1H-pyrazol-3-one

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