 Home > Encyclopedia > 4-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile structure

CAS No:
896066-72-1
Formula:
C25H21ClN4O2S
Chemical Name:
4-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile
Synonyms:
ZINC2430122;STK580584;AKOS005504442;MCULE-5721536277;ST50417017;4-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-ylthio}meth yl)benzenecarbonitrile;4-[({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzonitrile;896066-72-1

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4-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Basic Attributes

Molecular Weight：

477.0 g/mol

Exact Mass：

476.1073748 g/mol

Characteristics

PSA：

98.3 Å²

Computed Properties

Molecular Weight:477.0
XLogP3:5.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:476.1073748
Monoisotopic Mass:476.1073748
Topological Polar Surface Area:98.3
Heavy Atom Count:33
Complexity:625
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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