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2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide

2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide structure

CAS No:
578700-40-0
Formula:
C21H16F3N5O2S
Chemical Name:
2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Synonyms:
ZINC2386988;STL341673;AKOS002190816;MCULE-8047571976;2-{[4-(furan-2-ylmethyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide;ST50085175;2-[4-(2-furylmethyl)-5-(3-pyridyl)(1,2,4-triazol-3-ylthio)]-N-[3-(trifluoromet hyl)phenyl]acetamide;578700-40-0

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2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide Basic Attributes

Molecular Weight：

459.4 g/mol

Exact Mass：

459.09768043 g/mol

Characteristics

PSA：

111 Å²

Computed Properties

Molecular Weight:459.4
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:459.09768043
Monoisotopic Mass:459.09768043
Topological Polar Surface Area:111
Heavy Atom Count:32
Complexity:629
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide

Basic Attributes
Characteristics
Computed Properties

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