N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide
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![N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/1c09811460f24516a20dfa1de74642c9.png "N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide")
N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide
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CAS No:
957047-30-2
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Formula:
C21H24N2O6
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Chemical Name:
N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide
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Synonyms:
MLS001010627;CHEMBL1613250;HMS2730A07;ZINC2618065;AKOS034827232;MCULE-1334987509;SMR000352857;Z56999504;(2S)-N-(2H-1,3-benzodioxol-5-yl)-2-[(3,5-dimethoxyphenyl)formamido]-3-methylbutanamide;957047-30-2
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CAS No:
N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-3,5-dimethoxybenzamide Basic Attributes
400.4 g/mol
400.16343649 g/mol
Computed Properties
Molecular Weight:400.4
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:400.16343649
Monoisotopic Mass:400.16343649
Topological Polar Surface Area:95.1
Heavy Atom Count:29
Complexity:559
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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