(2S)-4-amino-2-[(5-chloro-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)amino]-4-oxobutanoic acid
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![(2S)-4-amino-2-[(5-chloro-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)amino]-4-oxobutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b8736dd5bd714380a8f4c03d59d05917.png "(2S)-4-amino-2-[(5-chloro-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)amino]-4-oxobutanoic acid")
(2S)-4-amino-2-[(5-chloro-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)amino]-4-oxobutanoic acid
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CAS No:
64398-39-6
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Formula:
C15H15ClN2O6
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Chemical Name:
(2S)-4-amino-2-[(5-chloro-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)amino]-4-oxobutanoic acid
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Synonyms:
64398-39-6;L-Asparagine, N2-((5-chloro-3,4-dihydro-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl)-;DTXSID70982960;N-[(5-Chloro-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl)(hydroxy)methylidene]-4-iminohomoserine
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CAS No:
(2S)-4-amino-2-[(5-chloro-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl)amino]-4-oxobutanoic acid Basic Attributes
354.74 g/mol
354.0618639 g/mol
Computed Properties
Molecular Weight:354.74
XLogP3:0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:354.0618639
Monoisotopic Mass:354.0618639
Topological Polar Surface Area:136
Heavy Atom Count:24
Complexity:554
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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