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2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone

2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone structure

CAS No:
714287-49-7
Formula:
C23H18ClN3O3S
Chemical Name:
2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone
Synonyms:
ZINC2596377;STK568608;AKOS005494131;MCULE-2100622562;ST50424520;1-(3,4-dihydroxyphenyl)-2-[5-(4-chlorophenyl)-4-(4-methylphenyl)(1,2,4-triazol -3-ylthio)]ethan-1-one;2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethanone;714287-49-7

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2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone Basic Attributes

Molecular Weight：

451.9 g/mol

Exact Mass：

451.0757403 g/mol

Characteristics

PSA：

114 Å²

Computed Properties

Molecular Weight:451.9
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:451.0757403
Monoisotopic Mass:451.0757403
Topological Polar Surface Area:114
Heavy Atom Count:31
Complexity:599
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydroxyphenyl)ethanone

Basic Attributes
Characteristics
Computed Properties

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