1-(azepan-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
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![1-(azepan-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/39e9d66d447e4f17b82da45d49b0d5c2.png "1-(azepan-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone")
1-(azepan-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
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CAS No:
796093-76-0
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Formula:
C14H18N4OS2
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Chemical Name:
1-(azepan-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
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Synonyms:
ZINC3344133;AKOS002499748;MCULE-4073420882;Z19451147;1-(azepan-1-yl)-2-{[5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;796093-76-0
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CAS No:
1-(azepan-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Basic Attributes
322.5 g/mol
322.09220356 g/mol
Computed Properties
Molecular Weight:322.5
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:322.09220356
Monoisotopic Mass:322.09220356
Topological Polar Surface Area:115
Heavy Atom Count:21
Complexity:350
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1-(azepan-1-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
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