(2S)-3-(1H-indol-3-yl)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]propanoic acid
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![(2S)-3-(1H-indol-3-yl)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/dd7fe1e761b74698ab91d96b1d5fe3b9.png "(2S)-3-(1H-indol-3-yl)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]propanoic acid")
(2S)-3-(1H-indol-3-yl)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]propanoic acid
structure -
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CAS No:
956382-87-9
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Formula:
C30H28N2O6
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Chemical Name:
(2S)-3-(1H-indol-3-yl)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]propanoic acid
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Synonyms:
ZINC2107922;EiM07-29649;AKOS030500044;MCULE-6397895963;956382-87-9
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CAS No:
(2S)-3-(1H-indol-3-yl)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]propanoic acid Basic Attributes
512.6 g/mol
512.19473662 g/mol
Computed Properties
Molecular Weight:512.6
XLogP3:4.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:512.19473662
Monoisotopic Mass:512.19473662
Topological Polar Surface Area:122
Heavy Atom Count:38
Complexity:980
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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