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

1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone structure

CAS No:
786723-84-0
Formula:
C22H22N4OS2
Chemical Name:
1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Synonyms:
ZINC3372995;AKOS033739686;MCULE-1816858842;Z20253223;1-{2,5-dimethyl-1-[(thiophen-2-yl)methyl]-1H-pyrrol-3-yl}-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one;786723-84-0

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

Molecular Weight：

422.6 g/mol

Exact Mass：

422.12350369 g/mol

Characteristics

PSA：

106 Å²

Computed Properties

Molecular Weight:422.6
XLogP3:4.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:422.12350369
Monoisotopic Mass:422.12350369
Topological Polar Surface Area:106
Heavy Atom Count:29
Complexity:559
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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