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

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

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

CAS No:
851215-01-5
Formula:
C25H27N5O2S
Chemical Name:
1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Synonyms:
ZINC3348045;AKOS033685704;MCULE-7185415100;Z19475997;1-(1-benzyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-{[4-(2-methoxyethyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;851215-01-5

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

Molecular Weight：

461.6 g/mol

Exact Mass：

461.18854629 g/mol

Characteristics

PSA：

100 Å²

Computed Properties

Molecular Weight:461.6
XLogP3:3.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:461.18854629
Monoisotopic Mass:461.18854629
Topological Polar Surface Area:100
Heavy Atom Count:33
Complexity:614
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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