 Home > Encyclopedia > 1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone structure

CAS No:
756855-51-3
Formula:
C21H25N5O2S
Chemical Name:
1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Synonyms:
ZINC2664757;AKOS033904255;MCULE-9871576994;Z24172019;1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;756855-51-3

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1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Basic Attributes

Molecular Weight：

411.5 g/mol

Exact Mass：

411.17289623 g/mol

Characteristics

PSA：

100 Å²

Computed Properties

Molecular Weight:411.5
XLogP3:2.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:411.17289623
Monoisotopic Mass:411.17289623
Topological Polar Surface Area:100
Heavy Atom Count:29
Complexity:545
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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