[2-(2-cyanoanilino)-2-oxoethyl] (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate
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[2-(2-cyanoanilino)-2-oxoethyl] (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate
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CAS No:
956684-27-8
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Formula:
C20H18ClN3O5S
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Chemical Name:
[2-(2-cyanoanilino)-2-oxoethyl] (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate
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Synonyms:
ZINC3337561;AKOS034826488;MCULE-3098093546;AB00720114-01;SR-01000044922;SR-01000044922-1;Z56929025;[(2-cyanophenyl)carbamoyl]methyl (2S)-1-(4-chlorobenzenesulfonyl)pyrrolidine-2-carboxylate;956684-27-8
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CAS No:
[2-(2-cyanoanilino)-2-oxoethyl] (2S)-1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Basic Attributes
447.9 g/mol
447.0655696 g/mol
Computed Properties
Molecular Weight:447.9
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:447.0655696
Monoisotopic Mass:447.0655696
Topological Polar Surface Area:125
Heavy Atom Count:30
Complexity:782
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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