1-{5-[(2-aminophenyl)sulfanyl]-3-bromo-1H-1,2,4-triazol-1-yl}acetone
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![1-{5-[(2-aminophenyl)sulfanyl]-3-bromo-1H-1,2,4-triazol-1-yl}acetone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/843773d7492e4b35ad011033aac53fdb.png "1-{5-[(2-aminophenyl)sulfanyl]-3-bromo-1H-1,2,4-triazol-1-yl}acetone")
1-{5-[(2-aminophenyl)sulfanyl]-3-bromo-1H-1,2,4-triazol-1-yl}acetone
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CAS No:
914357-54-3
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Formula:
C11H11BrN4OS
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Chemical Name:
1-{5-[(2-aminophenyl)sulfanyl]-3-bromo-1H-1,2,4-triazol-1-yl}acetone
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Synonyms:
1-{5-[(2-aminophenyl)sulfanyl]-3-bromo-1H-1,2,4-triazol-1-yl}acetone;ZINC8715898;STK273823;AKOS003380123;MCULE-8703426009;AP-853/43387168;1-(5-((2-aminophenyl)thio)-3-bromo-1H-1,2,4-triazol-1-yl)propan-2-one;1-{5-[(2-aminophenyl)sulfanyl]-3-bromo-1H-1,2,4-triazol-1-yl}propan-2-one
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CAS No:
1-{5-[(2-aminophenyl)sulfanyl]-3-bromo-1H-1,2,4-triazol-1-yl}acetone Basic Attributes
327.20024
325.98369 g/mol
Computed Properties
Molecular Weight:327.20
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:325.98369
Monoisotopic Mass:325.98369
Topological Polar Surface Area:99.1
Heavy Atom Count:18
Complexity:307
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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