 Home > Encyclopedia > 1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone structure

CAS No:
757225-64-2
Formula:
C25H25N5OS
Chemical Name:
1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Synonyms:
ZINC2619306;AKOS002496719;MCULE-5401266040;Z19445299;1-[2,5-dimethyl-1-(prop-2-en-1-yl)-1H-pyrrol-3-yl]-2-{[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;757225-64-2

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1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone Basic Attributes

Molecular Weight：

443.6 g/mol

Exact Mass：

443.17798161 g/mol

Characteristics

PSA：

90.9 Å²

Computed Properties

Molecular Weight:443.6
XLogP3:4.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:443.17798161
Monoisotopic Mass:443.17798161
Topological Polar Surface Area:90.9
Heavy Atom Count:32
Complexity:642
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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