3-[4-(2-bromo-4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one
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![3-[4-(2-bromo-4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4f30644bdae54164bc3e9aa07c1d4fc8.png "3-[4-(2-bromo-4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one")
3-[4-(2-bromo-4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one
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CAS No:
696624-17-6
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Formula:
C20H18BrN5OS
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Chemical Name:
3-[4-(2-bromo-4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one
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Synonyms:
Oprea1_506891;MLS000769110;CHEMBL1508056;HMS2787O18;ZINC9087626;STK775159;AKOS005614722;MCULE-9466292196;SMR000433887;3-(4-(2-bromo-4-methylphenyl)-5-mercapto-4H-1,2,4-triazol-3-yl)-1-ethyl-7-methyl-1,8-naphthyridin-4(1H)-one;3-[4-(2-Bromo-4-methyl-phenyl)-5-mercapto-4H-[1,2,4]triazol-3-yl]-1-ethyl-7-methyl-1H-[1,8]naphthyridin -4-one;3-[4-(2-bromo-4-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4(1H)-one;696624-17-6
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CAS No:
3-[4-(2-bromo-4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one Basic Attributes
456.4 g/mol
455.04154 g/mol
Computed Properties
Molecular Weight:456.4
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:455.04154
Monoisotopic Mass:455.04154
Topological Polar Surface Area:92.9
Heavy Atom Count:28
Complexity:725
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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