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

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

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

CAS No:
749877-75-6
Formula:
C23H23N5OS
Chemical Name:
1-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Synonyms:
ZINC2644918;AKOS033739498;MCULE-4991462210;AB00723985-01;Z20251441;1-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;749877-75-6

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

Molecular Weight：

417.5 g/mol

Exact Mass：

417.16233155 g/mol

Characteristics

PSA：

90.9 Å²

Computed Properties

Molecular Weight:417.5
XLogP3:3.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:417.16233155
Monoisotopic Mass:417.16233155
Topological Polar Surface Area:90.9
Heavy Atom Count:30
Complexity:578
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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