 Home > Encyclopedia > 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone structure

CAS No:
565180-32-7
Formula:
C25H23N5OS
Chemical Name:
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Synonyms:
ZINC3319358;AKOS033668051;MCULE-7782261199;Z19257439;2-{[4-(2-methylphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one;565180-32-7

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1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone Basic Attributes

Molecular Weight：

441.5 g/mol

Exact Mass：

441.16233155 g/mol

Characteristics

PSA：

89.2 Å²

Computed Properties

Molecular Weight:441.5
XLogP3:3.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:441.16233155
Monoisotopic Mass:441.16233155
Topological Polar Surface Area:89.2
Heavy Atom Count:32
Complexity:636
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: carbon disulfide; nitrite chemical formula; ch3cl; lithium phosphate formula; bromobenzene; sulfur trioxide formula

Guide of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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