 Home > Encyclopedia > 4-(3,4-dimethylphenyl)-5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione

4-(3,4-dimethylphenyl)-5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione

4-(3,4-dimethylphenyl)-5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione structure

CAS No:
721408-81-7
Formula:
C25H27N7S
Chemical Name:
4-(3,4-dimethylphenyl)-5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione
Synonyms:
ZINC57457763;AKOS034338025;MCULE-1222753794;Z44121606;4-(3,4-dimethylphenyl)-3-phenyl-1-{[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}-4,5-dihydro-1H-1,2,4-triazole-5-thione;721408-81-7

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4-(3,4-dimethylphenyl)-5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Basic Attributes

Molecular Weight：

457.6 g/mol

Exact Mass：

457.20486506 g/mol

Characteristics

PSA：

83.2 Å²

Computed Properties

Molecular Weight:457.6
XLogP3:4.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:457.20486506
Monoisotopic Mass:457.20486506
Topological Polar Surface Area:83.2
Heavy Atom Count:33
Complexity:695
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(3,4-dimethylphenyl)-5-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione

Basic Attributes
Characteristics
Computed Properties

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