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6-(1-adamantyl)-2-[(4-chlorobenzyl)sulfanyl]nicotinonitrile

6-(1-adamantyl)-2-[(4-chlorobenzyl)sulfanyl]nicotinonitrile structure

CAS No:
340817-01-8
Formula:
C23H23ClN2S
Chemical Name:
6-(1-adamantyl)-2-[(4-chlorobenzyl)sulfanyl]nicotinonitrile
Synonyms:
6-(1-adamantyl)-2-[(4-chlorobenzyl)sulfanyl]nicotinonitrile;Oprea1_086912;ZINC4734210;STK525996;AKOS005459607;MCULE-9290493860;AK-777/11500014;2-[(4-chlorobenzyl)sulfanyl]-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)pyridine-3-carbonitrile;340817-01-8

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6-(1-adamantyl)-2-[(4-chlorobenzyl)sulfanyl]nicotinonitrile Basic Attributes

Molecular Weight：

394.96012

Exact Mass：

394.127

Characteristics

PSA：

XLogP3：

6.4

Computed Properties

Molecular Weight:395.0
XLogP3:6.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:394.1270476
Monoisotopic Mass:394.1270476
Topological Polar Surface Area:62
Heavy Atom Count:27
Complexity:549
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-(1-adamantyl)-2-[(4-chlorobenzyl)sulfanyl]nicotinonitrile

Basic Attributes
Characteristics
Computed Properties

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