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2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile

2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile structure

CAS No:
313380-15-3
Formula:
C20H19F3N4OS
Chemical Name:
2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Synonyms:
STL324007;ZINC20813970;AKOS003682966;MCULE-8973860000;2-{[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile;313380-15-3

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2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Basic Attributes

Molecular Weight：

420.5 g/mol

Exact Mass：

420.12316690 g/mol

Characteristics

PSA：

85.5 Å²

Computed Properties

Molecular Weight:420.5
XLogP3:3.3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:420.12316690
Monoisotopic Mass:420.12316690
Topological Polar Surface Area:85.5
Heavy Atom Count:29
Complexity:609
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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