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1-(azepan-1-yl)-2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone
1-(azepan-1-yl)-2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone
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![1-(azepan-1-yl)-2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9c4e399d04c84d2c86f7f7bf21ef5cfe.png "1-(azepan-1-yl)-2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone")
1-(azepan-1-yl)-2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone
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CAS No:
851205-92-0
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Formula:
C16H19BrN4OS
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Chemical Name:
1-(azepan-1-yl)-2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone
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Synonyms:
ZINC3345865;AKOS033942330;MCULE-7124034263;Z25465896;1-(azepan-1-yl)-2-{[5-(4-bromophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;851205-92-0
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CAS No:
1-(azepan-1-yl)-2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone Basic Attributes
395.3 g/mol
394.04629 g/mol
Computed Properties
Molecular Weight:395.3
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:394.04629
Monoisotopic Mass:394.04629
Topological Polar Surface Area:87.2
Heavy Atom Count:23
Complexity:384
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1-(azepan-1-yl)-2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone
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