2-(3-butyl-4-methylquinolin-2-yl)sulfanylacetic acid
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2-(3-butyl-4-methylquinolin-2-yl)sulfanylacetic acid
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CAS No:
497231-20-6
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Formula:
C16H19NO2S
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Chemical Name:
2-(3-butyl-4-methylquinolin-2-yl)sulfanylacetic acid
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Synonyms:
ZINC2344164;STL302675;AKOS022126889;MCULE-5567377662;[(3-butyl-4-methylquinolin-2-yl)sulfanyl]acetic acid;497231-20-6
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CAS No:
2-(3-butyl-4-methylquinolin-2-yl)sulfanylacetic acid Basic Attributes
289.4 g/mol
289.11365002 g/mol
Computed Properties
Molecular Weight:289.4
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:289.11365002
Monoisotopic Mass:289.11365002
Topological Polar Surface Area:75.5
Heavy Atom Count:20
Complexity:324
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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