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1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
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![1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/072cb9a88f7f40579bfd4cad074db5c7.png "1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone")
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
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CAS No:
736147-47-0
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Formula:
C21H22N4O2S2
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Chemical Name:
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
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Synonyms:
ZINC3323330;AKOS033734138;MCULE-5102873248;Z20165338;2-({5-[(2-ethoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-1-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one;736147-47-0
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CAS No:
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Basic Attributes
426.6 g/mol
426.11841830 g/mol
Computed Properties
Molecular Weight:426.6
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:426.11841830
Monoisotopic Mass:426.11841830
Topological Polar Surface Area:121
Heavy Atom Count:29
Complexity:541
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(2-ethoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone
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