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1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone

1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone structure

CAS No:
721913-83-3
Formula:
C17H16N4OS
Chemical Name:
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone
Synonyms:
SMR000061933;MLS000098305;Enamine_004801;MLS002636811;CHEMBL1601460;HMS1407K05;HMS2166N21;HMS3308M04;ZINC3245942;AKOS033738473;MCULE-9232287213;SR-01000304238;SR-01000304238-1;Z20242480;2-[([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)acetyl]-1,2,3,4-tetrahydroisoquinoline;1-(1,2,3,4-tetrahydroisoquinolin-2-yl)-2-{[1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl}ethan-1-one;721913-83-3

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1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone Basic Attributes

Molecular Weight：

324.4 g/mol

Exact Mass：

324.10448232 g/mol

Characteristics

PSA：

75.8 Å²

Computed Properties

Molecular Weight:324.4
XLogP3:3.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:324.10448232
Monoisotopic Mass:324.10448232
Topological Polar Surface Area:75.8
Heavy Atom Count:23
Complexity:435
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone

Basic Attributes
Characteristics
Computed Properties

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