(2S)-2-[[2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylbutanoic acid
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![(2S)-2-[[2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylbutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2f828b94367a432eb6eb06fbca38a834.png "(2S)-2-[[2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylbutanoic acid")
(2S)-2-[[2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylbutanoic acid
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CAS No:
956040-84-9
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Formula:
C20H23ClN2O7
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Chemical Name:
(2S)-2-[[2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylbutanoic acid
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Synonyms:
ZINC2116670;STL531755;AKOS030502335;MCULE-8318556034;N-[(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-valine;(S)-2-(2-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)acetamido)-3-methylbutanoic acid;956040-84-9
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CAS No:
(2S)-2-[[2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylbutanoic acid Basic Attributes
438.9 g/mol
438.1193788 g/mol
Computed Properties
Molecular Weight:438.9
XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:438.1193788
Monoisotopic Mass:438.1193788
Topological Polar Surface Area:131
Heavy Atom Count:30
Complexity:737
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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