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2-(1,3-benzothiazol-2-yl)-3-(4-bromophenyl)acrylonitrile

2-(1,3-benzothiazol-2-yl)-3-(4-bromophenyl)acrylonitrile structure

CAS No:
118055-19-9
Formula:
C16H9BrN2S
Chemical Name:
2-(1,3-benzothiazol-2-yl)-3-(4-bromophenyl)acrylonitrile
Synonyms:
2-(1,3-benzothiazol-2-yl)-3-(4-bromophenyl)acrylonitrile;ZINC13601368;AKOS000593566;AG-690/11739115;118055-19-9

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2-(1,3-benzothiazol-2-yl)-3-(4-bromophenyl)acrylonitrile Basic Attributes

Molecular Weight：

341.22506

Exact Mass：

339.967

Characteristics

PSA：

64.9

XLogP3：

4.9

Computed Properties

Molecular Weight:341.2
XLogP3:4.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:339.96698
Monoisotopic Mass:339.96698
Topological Polar Surface Area:64.9
Heavy Atom Count:20
Complexity:419
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1,3-benzothiazol-2-yl)-3-(4-bromophenyl)acrylonitrile

Basic Attributes
Characteristics
Computed Properties

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