2-(6-methoxyquinolin-4-yl)sulfanylacetic acid
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2-(6-methoxyquinolin-4-yl)sulfanylacetic acid
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CAS No:
5450-23-7
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Formula:
C12H11NO3S
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Chemical Name:
2-(6-methoxyquinolin-4-yl)sulfanylacetic acid
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Synonyms:
NSC13581;5450-23-7;NSC-13581;2-((6-Methoxyquinolin-4-yl)thio)acetic acid;2-(6-methoxyquinolin-4-yl)sulfanylacetic acid;NCIStruc1_000523;NCIStruc2_000965;CHEMBL1742072;DTXSID20279650;NCI13581;ZINC1591886;CCG-38164;NCGC00013161;AKOS002683662;NCGC00013161-02;NCGC00096282-01;NCI60_000803;((6-methoxy-4-quinolinyl)thio)acetic acid
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CAS No:
2-(6-methoxyquinolin-4-yl)sulfanylacetic acid Basic Attributes
249.29 g/mol
249.04596439 g/mol
13581
DTXSID20279650
Computed Properties
Molecular Weight:249.29
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:249.04596439
Monoisotopic Mass:249.04596439
Topological Polar Surface Area:84.7
Heavy Atom Count:17
Complexity:275
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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