(E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoic acid
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(E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoic acid
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CAS No:
327094-09-7
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Formula:
C20H21NO6S
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Chemical Name:
(E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoic acid
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Synonyms:
MLS000778021;CHEMBL1559986;HMS2748M18;ZINC1473376;STL300063;AKOS000807313;SMR000414415;(2E)-3-[3-(3,4-dihydroquinolin-1(2H)-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoic acid;(E)-3-[3-(3,4-Dihydro-2H-quinoline-1-sulfonyl)-4,5-dimethoxy-phenyl]-acrylic acid;327094-09-7
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CAS No:
(E)-3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoic acid Basic Attributes
403.5 g/mol
403.10895856 g/mol
Computed Properties
Molecular Weight:403.5
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:403.10895856
Monoisotopic Mass:403.10895856
Topological Polar Surface Area:102
Heavy Atom Count:28
Complexity:673
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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