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2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile

2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile structure

CAS No:
342780-33-0
Formula:
C19H10ClF3N2O2S2
Chemical Name:
2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile
Synonyms:
2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile

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2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile Basic Attributes

Molecular Weight：

454.8731096

Exact Mass：

453.982

Characteristics

PSA：

109

XLogP3：

5.6

Computed Properties

Molecular Weight:454.9
XLogP3:5.6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:453.9824321
Monoisotopic Mass:453.9824321
Topological Polar Surface Area:109
Heavy Atom Count:29
Complexity:634
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile

Basic Attributes
Characteristics
Computed Properties

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