 Home > Encyclopedia > 4-(3-methylbutyl)-1-[[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylmethyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one

4-(3-methylbutyl)-1-[[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylmethyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one

4-(3-methylbutyl)-1-[[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylmethyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one structure

CAS No:
784171-79-5
Formula:
C24H29N5O2S
Chemical Name:
4-(3-methylbutyl)-1-[[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylmethyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Synonyms:
SMR000067585;MLS000053331;MLS000863808;HMS1717J02;AKOS034366997;MCULE-1958129233;Z45393084;4-(3-methylbutyl)-1-({[2-oxo-2-(1,2,5-trimethyl-1H-pyrrol-3-yl)ethyl]sulfanyl}methyl)-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-5-one;784171-79-5

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4-(3-methylbutyl)-1-[[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylmethyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one Basic Attributes

Molecular Weight：

451.6 g/mol

Exact Mass：

451.20419636 g/mol

Characteristics

PSA：

98.3 Å²

Computed Properties

Molecular Weight:451.6
XLogP3:3.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:451.20419636
Monoisotopic Mass:451.20419636
Topological Polar Surface Area:98.3
Heavy Atom Count:32
Complexity:691
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(3-methylbutyl)-1-[[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]sulfanylmethyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Basic Attributes
Characteristics
Computed Properties

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