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

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

CAS No:
757198-27-9
Formula:
C23H23N5OS
Chemical Name:
2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone
Synonyms:
MLS000057150;SMR000063988;MLS002633602;CHEMBL1492705;BDBM36971;cid_2079854;HMS2351M10;ZINC2617959;AKOS002499752;MCULE-5950201825;2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone;Z19445452;2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone;2-[[4-(o-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone;2-{[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1,2,5-trimethyl-1H-pyrrol-3-yl)ethan-1-one;757198-27-9

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2-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)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:586
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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