3-butyl-2-methyl-4-sulfanylidene-1H-quinoline-6-carboxylic acid
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3-butyl-2-methyl-4-sulfanylidene-1H-quinoline-6-carboxylic acid
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CAS No:
419553-62-1
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Formula:
C15H17NO2S
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Chemical Name:
3-butyl-2-methyl-4-sulfanylidene-1H-quinoline-6-carboxylic acid
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Synonyms:
CBMicro_028029;Oprea1_252796;ZINC2591753;STK559557;AKOS005485410;AKOS030520448;MCULE-3505360064;BIM-0028048.P001;3-butyl-2-methyl-4-thioxo-1,4-dihydroquinoline-6-carboxylic acid;419553-62-1
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CAS No:
3-butyl-2-methyl-4-sulfanylidene-1H-quinoline-6-carboxylic acid Basic Attributes
275.4 g/mol
275.09799996 g/mol
Computed Properties
Molecular Weight:275.4
XLogP3:3.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:275.09799996
Monoisotopic Mass:275.09799996
Topological Polar Surface Area:81.4
Heavy Atom Count:19
Complexity:416
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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