(2S)-3-methyl-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]butanoic acid
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![(2S)-3-methyl-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b706f009958a4642bd8ce71927ab5a52.png "(2S)-3-methyl-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]butanoic acid")
(2S)-3-methyl-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]butanoic acid
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CAS No:
956048-12-7
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Formula:
C21H21NO6
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Chemical Name:
(2S)-3-methyl-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]butanoic acid
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Synonyms:
ZINC2124622;STL530219;AKOS032428035;MCULE-9634398189;N-{[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetyl}-L-valine;(S)-3-methyl-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)butanoic acid;956048-12-7
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CAS No:
(2S)-3-methyl-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]butanoic acid Basic Attributes
383.4 g/mol
383.13688739 g/mol
Computed Properties
Molecular Weight:383.4
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:383.13688739
Monoisotopic Mass:383.13688739
Topological Polar Surface Area:102
Heavy Atom Count:28
Complexity:606
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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