[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(4-bromo-2,5-dimethylphenyl)sulfanylacetate
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![[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(4-bromo-2,5-dimethylphenyl)sulfanylacetate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5beac1403803410e8cfe4e43e445d483.png "[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(4-bromo-2,5-dimethylphenyl)sulfanylacetate")
[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(4-bromo-2,5-dimethylphenyl)sulfanylacetate
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CAS No:
380569-78-8
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Formula:
C20H20BrNO5S
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Chemical Name:
[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(4-bromo-2,5-dimethylphenyl)sulfanylacetate
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Synonyms:
SMR000260036;MLS000390999;MLS003915423;CHEMBL1486339;HMS2588H05;ZINC3234685;AKOS033700283;MCULE-9015880118;Z19687493;{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl 2-[(4-bromo-2,5-dimethylphenyl)sulfanyl]acetate;380569-78-8
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CAS No:
[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(4-bromo-2,5-dimethylphenyl)sulfanylacetate Basic Attributes
466.3 g/mol
465.02456 g/mol
Computed Properties
Molecular Weight:466.3
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:465.02456
Monoisotopic Mass:465.02456
Topological Polar Surface Area:99.2
Heavy Atom Count:28
Complexity:551
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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