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2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole-3-thione

2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole-3-thione structure

CAS No:
745029-46-3
Formula:
C17H22F3N5O2S2
Chemical Name:
2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole-3-thione
Synonyms:
ZINC21322011;AKOS034338630;MCULE-1590243961;AB00992581-01;Z44136481;1-{[4-(2,4-dimethylbenzenesulfonyl)piperazin-1-yl]methyl}-4-methyl-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazole-5-thione;745029-46-3

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2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole-3-thione Basic Attributes

Molecular Weight：

449.5 g/mol

Exact Mass：

449.11670179 g/mol

Characteristics

PSA：

99.9 Å²

Computed Properties

Molecular Weight:449.5
XLogP3:2.8
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:449.11670179
Monoisotopic Mass:449.11670179
Topological Polar Surface Area:99.9
Heavy Atom Count:29
Complexity:760
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole-3-thione

Basic Attributes
Characteristics
Computed Properties

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