[2-tert-butyl-5-methyl-4-(2-nitrophenyl)sulfanylpyrazol-3-yl] 3-nitrobenzoate
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[2-tert-butyl-5-methyl-4-(2-nitrophenyl)sulfanylpyrazol-3-yl] 3-nitrobenzoate
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CAS No:
851127-68-9
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Formula:
C21H20N4O6S
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Chemical Name:
[2-tert-butyl-5-methyl-4-(2-nitrophenyl)sulfanylpyrazol-3-yl] 3-nitrobenzoate
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Synonyms:
851127-68-9;1-(tert-butyl)-3-methyl-4-((2-nitrophenyl)thio)-1H-pyrazol-5-yl 3-nitrobenzoate;1-tert-butyl-3-methyl-4-[(2-nitrophenyl)sulfanyl]-1H-pyrazol-5-yl 3-nitrobenzoate;Oprea1_610730;ZINC2718611;AKOS024584585;MCULE-7774276598;[2-tert-butyl-5-methyl-4-(2-nitrophenyl)sulfanylpyrazol-3-yl] 3-nitrobenzoate;F0569-0631
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CAS No:
[2-tert-butyl-5-methyl-4-(2-nitrophenyl)sulfanylpyrazol-3-yl] 3-nitrobenzoate Basic Attributes
456.5 g/mol
456.11035554 g/mol
Computed Properties
Molecular Weight:456.5
XLogP3:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:456.11035554
Monoisotopic Mass:456.11035554
Topological Polar Surface Area:161
Heavy Atom Count:32
Complexity:706
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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