 Home > Encyclopedia > 2-[[5-(3-chloro-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone

2-[[5-(3-chloro-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone

2-[[5-(3-chloro-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone structure

CAS No:
494825-54-6
Formula:
C21H15Cl2N3OS2
Chemical Name:
2-[[5-(3-chloro-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone
Synonyms:
ZINC1825173;STK806922;AKOS000807239;MCULE-1122295018;ST50776371;2-[5-(3-chlorobenzo[b]thiophen-2-yl)-4-prop-2-enyl(1,2,4-triazol-3-ylthio)]-1- (4-chlorophenyl)ethan-1-one;2-{[5-(3-chloro-1-benzothiophen-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-chlorophenyl)ethanone;494825-54-6

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2-[[5-(3-chloro-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone Basic Attributes

Molecular Weight：

460.4 g/mol

Exact Mass：

459.0033598 g/mol

Characteristics

PSA：

101 Å²

Computed Properties

Molecular Weight:460.4
XLogP3:6.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:459.0033598
Monoisotopic Mass:459.0033598
Topological Polar Surface Area:101
Heavy Atom Count:29
Complexity:590
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[5-(3-chloro-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-chlorophenyl)ethanone

Basic Attributes
Characteristics
Computed Properties

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