[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
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![[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4e69e65740344429a35606fab917ff97.png "[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate")
[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
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CAS No:
744230-94-2
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Formula:
C23H22N2O5S
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Chemical Name:
[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
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Synonyms:
744230-94-2;ZINC2634509;AKOS000867850;MCULE-6399410865;SR-01000051182;SR-01000051182-1;Z18837599;2-(1-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl 2-(methylthio)nicotinate;2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl 2-(methylsulfanyl)pyridine-3-carboxylate
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CAS No:
[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Basic Attributes
438.5 g/mol
438.12494298 g/mol
Computed Properties
Molecular Weight:438.5
XLogP3:3.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:438.12494298
Monoisotopic Mass:438.12494298
Topological Polar Surface Area:105
Heavy Atom Count:31
Complexity:650
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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