[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 3-(4-methylphenyl)sulfonylpropanoate
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![[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 3-(4-methylphenyl)sulfonylpropanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ed2bf56429e044668a9b61f08022a5a2.png "[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 3-(4-methylphenyl)sulfonylpropanoate")
[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 3-(4-methylphenyl)sulfonylpropanoate
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CAS No:
745025-26-7
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Formula:
C26H27NO7S
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Chemical Name:
[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 3-(4-methylphenyl)sulfonylpropanoate
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Synonyms:
ZINC2637741;AKOS000814726;CCG-284482;MCULE-2902095382;Z13638495;2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl 3-(4-methylbenzenesulfonyl)propanoate;745025-26-7
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CAS No:
[2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 3-(4-methylphenyl)sulfonylpropanoate Basic Attributes
497.6 g/mol
497.15082337 g/mol
Computed Properties
Molecular Weight:497.6
XLogP3:3.7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:497.15082337
Monoisotopic Mass:497.15082337
Topological Polar Surface Area:109
Heavy Atom Count:35
Complexity:848
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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