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3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-6-nitro-1,3-benzothiazole-2-thione

3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-6-nitro-1,3-benzothiazole-2-thione structure

CAS No:
721896-36-2
Formula:
C20H22N4O2S2
Chemical Name:
3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-6-nitro-1,3-benzothiazole-2-thione
Synonyms:
ZINC25158978;AKOS034338404;MCULE-6525240551;Z44126919;3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}-6-nitro-2,3-dihydro-1,3-benzothiazole-2-thione;721896-36-2

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3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-6-nitro-1,3-benzothiazole-2-thione Basic Attributes

Molecular Weight：

414.5 g/mol

Exact Mass：

414.11841830 g/mol

Characteristics

PSA：

113 Å²

Computed Properties

Molecular Weight:414.5
XLogP3:4.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:414.11841830
Monoisotopic Mass:414.11841830
Topological Polar Surface Area:113
Heavy Atom Count:28
Complexity:593
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-6-nitro-1,3-benzothiazole-2-thione

Basic Attributes
Characteristics
Computed Properties

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