(2S)-3-(1H-indol-3-yl)-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid
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![(2S)-3-(1H-indol-3-yl)-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2a71e64f256347128b1daf5514383b1a.png "(2S)-3-(1H-indol-3-yl)-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid")
(2S)-3-(1H-indol-3-yl)-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid
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CAS No:
956181-31-0
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Formula:
C25H22N2O6
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Chemical Name:
(2S)-3-(1H-indol-3-yl)-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid
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Synonyms:
ZINC2094401;AKOS030497547;(S)-3-(1H-indol-3-yl)-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)propanoic acid;956181-31-0
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CAS No:
(2S)-3-(1H-indol-3-yl)-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]propanoic acid Basic Attributes
446.5 g/mol
446.14778643 g/mol
Computed Properties
Molecular Weight:446.5
XLogP3:3.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:446.14778643
Monoisotopic Mass:446.14778643
Topological Polar Surface Area:118
Heavy Atom Count:33
Complexity:826
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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