(2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid
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![(2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d7c3254d91c34175a47a6f03a845c40c.png "(2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid")
(2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid
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CAS No:
1014049-08-1
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Formula:
C24H21ClN2O6
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Chemical Name:
(2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid
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Synonyms:
ZINC2123086;STK583982;AKOS005507330;MCULE-3564703552;N-[(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-tryptophan;(S)-2-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)-3-(1H-indol-3-yl)propanoic acid;1014049-08-1
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CAS No:
(2S)-2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid Basic Attributes
468.9 g/mol
468.1088141 g/mol
Computed Properties
Molecular Weight:468.9
XLogP3:3.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:468.1088141
Monoisotopic Mass:468.1088141
Topological Polar Surface Area:118
Heavy Atom Count:33
Complexity:817
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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