 Home > Encyclopedia > 2-[[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone

2-[[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone

2-[[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone structure

CAS No:
488840-46-6
Formula:
C22H18ClN3O2S2
Chemical Name:
2-[[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone
Synonyms:
ZINC1836104;STK806931;AKOS000807195;MCULE-1498952246;ST50776387;2-[5-(3-chloro-6-methoxybenzo[b]thiophen-2-yl)-4-prop-2-enyl(1,2,4-triazol-3-y lthio)]-1-phenylethan-1-one;2-{[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone;488840-46-6

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2-[[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone Basic Attributes

Molecular Weight：

456.0 g/mol

Exact Mass：

455.0528969 g/mol

Characteristics

PSA：

111 Å²

Computed Properties

Molecular Weight:456.0
XLogP3:5.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:455.0528969
Monoisotopic Mass:455.0528969
Topological Polar Surface Area:111
Heavy Atom Count:30
Complexity:607
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: gonococcal; isoamyl acetate; ankle dislocation; iodide formula; sodium sulfite formula; l malic acid

Guide of 2-[[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylethanone

Basic Attributes
Characteristics
Computed Properties

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