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

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

CAS No:
764706-16-3
Formula:
C22H21N5OS
Chemical Name:
2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone
Synonyms:
MLS000058373;SMR000064042;MLS002633678;CHEMBL1525405;BDBM36989;cid_2083153;HMS2404P22;ZINC2621273;AKOS033739390;MCULE-9869669987;2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone;Z20250235;2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone;2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone;2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1,2,5-trimethyl-1H-pyrrol-3-yl)ethan-1-one;764706-16-3

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

Molecular Weight：

403.5 g/mol

Exact Mass：

403.14668148 g/mol

Characteristics

PSA：

90.9 Å²

Computed Properties

Molecular Weight:403.5
XLogP3:3.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:403.14668148
Monoisotopic Mass:403.14668148
Topological Polar Surface Area:90.9
Heavy Atom Count:29
Complexity:551
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(4-phenyl-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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