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

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

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

CAS No:
746605-37-8
Formula:
C25H22ClN5OS
Chemical Name:
2-[[4-(3-chloro-2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone
Synonyms:
ZINC2647267;AKOS000870094;MCULE-1995228974;Z19111161;2-{[4-(3-chloro-2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one;746605-37-8

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

Molecular Weight：

476.0 g/mol

Exact Mass：

475.1233592 g/mol

Characteristics

PSA：

89.2 Å²

Computed Properties

Molecular Weight:476.0
XLogP3:4.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:475.1233592
Monoisotopic Mass:475.1233592
Topological Polar Surface Area:89.2
Heavy Atom Count:33
Complexity:665
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: chemical formula for ethanol; ch3cl; anthracene; 2-hexanone; structure isopropyl; nickel bisulphate formula

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

Basic Attributes
Characteristics
Computed Properties

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