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Home > Encyclopedia > (2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 3-nitrobenzoate

(2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 3-nitrobenzoate

(2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 3-nitrobenzoate structure

(2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 3-nitrobenzoate 

structure
  • CAS No:

    851127-15-6

  • Formula:

    C21H21N3O4S

  • Chemical Name:

    (2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 3-nitrobenzoate

  • Synonyms:

    851127-15-6;1-tert-butyl-3-methyl-4-(phenylthio)-1H-pyrazol-5-yl 3-nitrobenzoate;1-tert-butyl-3-methyl-4-(phenylsulfanyl)-1H-pyrazol-5-yl 3-nitrobenzoate;Oprea1_780103;ZINC2718563;(2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 3-nitrobenzoate;AKOS001496131;MCULE-7641524008;EU-0021519;F0569-0540;1-(tert-butyl)-3-methyl-4-(phenylthio)-1H-pyrazol-5-yl 3-nitrobenzoate

(2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 3-nitrobenzoate Basic Attributes

411.5 g/mol

411.12527733 g/mol

Characteristics

115 Ų

Computed Properties

Molecular Weight:411.5
XLogP3:5.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:411.12527733
Monoisotopic Mass:411.12527733
Topological Polar Surface Area:115
Heavy Atom Count:29
Complexity:586
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (2-tert-butyl-5-methyl-4-phenylsulfanylpyrazol-3-yl) 3-nitrobenzoate

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