1,3-benzodioxol-5-yl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate
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![1,3-benzodioxol-5-yl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d25165cf406544ef8178d5850d0d1386.png "1,3-benzodioxol-5-yl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate")
1,3-benzodioxol-5-yl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate
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CAS No:
1040765-55-6
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Formula:
C20H21NO5
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Chemical Name:
1,3-benzodioxol-5-yl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate
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Synonyms:
ZINC3376625;AKOS034827596;MCULE-7891247965;Z57028940;2H-1,3-benzodioxol-5-yl (2S)-3-methyl-2-[(3-methylphenyl)formamido]butanoate;1040765-55-6
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CAS No:
1,3-benzodioxol-5-yl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate Basic Attributes
355.4 g/mol
355.14197277 g/mol
Computed Properties
Molecular Weight:355.4
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:355.14197277
Monoisotopic Mass:355.14197277
Topological Polar Surface Area:73.9
Heavy Atom Count:26
Complexity:508
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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