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butyl 4-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}phenyl ether

butyl 4-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}phenyl ether structure

CAS No:
57736-54-6
Formula:
C14H19N3OS
Chemical Name:
butyl 4-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}phenyl ether
Synonyms:
SMR000069977;MLS000061646;CHEMBL1329048;HMS2465L07;ZINC4257738;STK832978;AKOS000506256;MCULE-8654036812;ST50221952;AG-690/34034042

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butyl 4-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}phenyl ether Basic Attributes

Molecular Weight：

277.38516

Exact Mass：

277.125

Characteristics

PSA：

76.1

XLogP3：

3.9

Computed Properties

Molecular Weight:277.39
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:277.12488341
Monoisotopic Mass:277.12488341
Topological Polar Surface Area:76.1
Heavy Atom Count:19
Complexity:247
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of butyl 4-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}phenyl ether

Basic Attributes
Characteristics
Computed Properties
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