(2S)-1-(3-sulfanylpropanoyl)-3,4-dihydro-2H-quinoline-2-carboxylic acid
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(2S)-1-(3-sulfanylpropanoyl)-3,4-dihydro-2H-quinoline-2-carboxylic acid
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CAS No:
75494-01-8
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Formula:
C13H15NO3S
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Chemical Name:
(2S)-1-(3-sulfanylpropanoyl)-3,4-dihydro-2H-quinoline-2-carboxylic acid
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Synonyms:
1,2,3,4-tetrahydro-2 (3-mercapto-1-oxopropyl)-2-quinolinecarboxylic acid;EU 5031;EU-5031;EU 5031;75494-01-8;EU-5031;SCHEMBL11045862;DTXSID70226437;ZINC28261464;(2S)-1-(3-sulfanylpropanoyl)-3,4-dihydro-2H-quinoline-2-carboxylic acid;1,2,3,4-Tetrahydro-2 (3-mercapto-1-oxopropyl)-2-quinolinecarboxylic acid;(S)-1-(3-Mercaptopropanoyl)-1,2,3,4-tetrahydroquinoline-2-carboxylic acid;(S)(-)-1,2,3,4-tetrahydro-1-(3-mercapto-1-oxopropyl)-2-quinolinecarboxylic acid;2-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-1-(3-mercapto-1-oxopropyl)-, (S)-
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CAS No:
(2S)-1-(3-sulfanylpropanoyl)-3,4-dihydro-2H-quinoline-2-carboxylic acid Basic Attributes
265.33 g/mol
265.07726451 g/mol
DTXSID70226437
Computed Properties
Molecular Weight:265.33
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:265.07726451
Monoisotopic Mass:265.07726451
Topological Polar Surface Area:58.6
Heavy Atom Count:18
Complexity:334
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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