 Home > Encyclopedia > 1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone structure

CAS No:
745025-87-0
Formula:
C25H34N4O2S
Chemical Name:
1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Synonyms:
ZINC2637829;AKOS033428649;MCULE-8937646902;AB00723773-01;Z15607147;1-[2,5-dimethyl-1-(3-methylbutyl)-1H-pyrrol-3-yl]-2-{[5-(4-methoxyphenyl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;745025-87-0

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1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone Basic Attributes

Molecular Weight：

454.6 g/mol

Exact Mass：

454.24024751 g/mol

Characteristics

PSA：

87.2 Å²

Computed Properties

Molecular Weight:454.6
XLogP3:5.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:454.24024751
Monoisotopic Mass:454.24024751
Topological Polar Surface Area:87.2
Heavy Atom Count:32
Complexity:597
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 3-methylbutanal; methyl ethyl ketoxime; sodium tripolyphosphate; calcium bromide formula; fluoroethylene carbonate; melting point range acetanilide

Guide of 1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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