(2S)-1-[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]pyrrolidine-2-carboxylic acid
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![(2S)-1-[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]pyrrolidine-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ae84076f3b69465fa3fea09ee36bdccd.png "(2S)-1-[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]pyrrolidine-2-carboxylic acid")
(2S)-1-[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]pyrrolidine-2-carboxylic acid
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CAS No:
30743-27-2
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Formula:
C20H24I3N3O5
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Chemical Name:
(2S)-1-[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]pyrrolidine-2-carboxylic acid
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Synonyms:
30743-27-2;BRN 0504483;1-(3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)-L-proline;L-Proline, 1-(3,5-bis(acetylethylamino)-2,4,6-triiodobenzoyl)-;1-(3,5-Bis(N-aethyl-acetylamino)-2,4,6-trijod-benzoyl)-pyrrolidin-2-carbonsaure [German];DTXSID50952964;1-(3,5-Bis(N-aethyl-acetylamino)-2,4,6-trijod-benzoyl)-pyrrolidin-2-carbonsaure;Bis-3,5-(Trifluoromethyl)Fluorobenzene;A20444;1-{3,5-Bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl}proline
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CAS No:
(2S)-1-[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]pyrrolidine-2-carboxylic acid Basic Attributes
767.1 g/mol
766.8850 g/mol
Computed Properties
Molecular Weight:767.1
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:766.8850
Monoisotopic Mass:766.8850
Topological Polar Surface Area:98.2
Heavy Atom Count:31
Complexity:688
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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