(E)-4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)but-2-enoic acid
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(E)-4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)but-2-enoic acid
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CAS No:
315672-93-6
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Formula:
C14H16N2O5S
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Chemical Name:
(E)-4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)but-2-enoic acid
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Synonyms:
4-oxo-4-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-butenoic acid;315672-93-6;(E)-4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)but-2-enoic acid;(2E)-4-oxo-4-{[4-(pyrrolidin-1-ylsulfonyl)phenyl]amino}but-2-enoic acid;MLS000676476;ARONIS021652;CHEMBL1414847;HMS2677K16;ZINC313657;(E)-4-Oxo-4-[4-(1-pyrrolidinylsulfonyl)anilino]-2-butenoic acid;STK079193;AKOS000488143;SMR000299028;VU0308001-2;SR-01000250746;SR-01000250746-1;F3146-4020;(E)-4-oxo-4-((4-(pyrrolidin-1-ylsulfonyl)phenyl)amino)but-2-enoic acid
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CAS No:
(E)-4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)but-2-enoic acid Basic Attributes
324.35 g/mol
324.07799279 g/mol
Computed Properties
Molecular Weight:324.35
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:324.07799279
Monoisotopic Mass:324.07799279
Topological Polar Surface Area:112
Heavy Atom Count:22
Complexity:538
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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