2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(2,4,5-trimethylphenyl)ethanone
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2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(2,4,5-trimethylphenyl)ethanone
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CAS No:
851110-77-5
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Formula:
C13H15N3OS
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Chemical Name:
2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(2,4,5-trimethylphenyl)ethanone
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Synonyms:
ZINC6060065;AKOS005901044;MCULE-1882054762;Z18740345;2-(4H-1,2,4-triazol-3-ylsulfanyl)-1-(2,4,5-trimethylphenyl)ethan-1-one;851110-77-5
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CAS No:
2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(2,4,5-trimethylphenyl)ethanone Basic Attributes
261.34 g/mol
261.09358328 g/mol
Computed Properties
Molecular Weight:261.34
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:261.09358328
Monoisotopic Mass:261.09358328
Topological Polar Surface Area:83.9
Heavy Atom Count:18
Complexity:300
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(2,4,5-trimethylphenyl)ethanone
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