 Home > Encyclopedia > 1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone

1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone

1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone structure

CAS No:
745036-96-8
Formula:
C22H20N4O3S
Chemical Name:
1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone
Synonyms:
ZINC2639264;AKOS033738419;MCULE-9059305675;Z20242256;1-{1-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-{[1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl}ethan-1-one;745036-96-8

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1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone Basic Attributes

Molecular Weight：

420.5 g/mol

Exact Mass：

420.12561169 g/mol

Characteristics

PSA：

96 Å²

Computed Properties

Molecular Weight:420.5
XLogP3:4.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:420.12561169
Monoisotopic Mass:420.12561169
Topological Polar Surface Area:96
Heavy Atom Count:30
Complexity:625
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: tert butyl methyl ether; dipotassium oxide; acid capric; zafirlukast; hexanes sds; mercurochrome solution

Guide of 1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone

Basic Attributes
Characteristics
Computed Properties

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