4-[[4-(hydroxyamino)-4-oxo-1-phenylbutan-2-yl]amino]-2-[(4-hydroxy-3-iodophenyl)methyl]-4-oxobutanoic acid
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![4-[[4-(hydroxyamino)-4-oxo-1-phenylbutan-2-yl]amino]-2-[(4-hydroxy-3-iodophenyl)methyl]-4-oxobutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6dea2a7fa53b4fb79f9f3a7baba58b6d.png "4-[[4-(hydroxyamino)-4-oxo-1-phenylbutan-2-yl]amino]-2-[(4-hydroxy-3-iodophenyl)methyl]-4-oxobutanoic acid")
4-[[4-(hydroxyamino)-4-oxo-1-phenylbutan-2-yl]amino]-2-[(4-hydroxy-3-iodophenyl)methyl]-4-oxobutanoic acid
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CAS No:
145253-48-1
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Formula:
C21H23IN2O6
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Chemical Name:
4-[[4-(hydroxyamino)-4-oxo-1-phenylbutan-2-yl]amino]-2-[(4-hydroxy-3-iodophenyl)methyl]-4-oxobutanoic acid
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Synonyms:
2-((3-iodo-4-hydroxy)phenylmethyl)-4-N-(3-(hydroxyamino-3-oxo-1-phenylmethyl)propyl)amino-4-oxobutanoic acid;RB 104;RB-104;RB104;RB 104;RB-104;145253-48-1;Benzenepropanoic acid, 4-hydroxy-alpha-(2-((3-(hydroxyamino)-3-oxo-1-(phenylmethyl)propyl)amino)-2-oxoethyl)-3-iodo-;DTXSID10932545;RB104;2-((3-Iodo-4-hydroxy)phenylmethyl)-4-N-(3-(hydroxyamino-3-oxo-1-phenylmethyl)propyl)amino-4-oxobutanoic acid;4-Hydroxy-4-{[4-hydroxy-4-(hydroxyimino)-1-phenylbutan-2-yl]imino}-2-[(4-hydroxy-3-iodophenyl)methyl]butanoic acid
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CAS No:
4-[[4-(hydroxyamino)-4-oxo-1-phenylbutan-2-yl]amino]-2-[(4-hydroxy-3-iodophenyl)methyl]-4-oxobutanoic acid Basic Attributes
526.3 g/mol
526.06008 g/mol
Drug Information
2-((3-iodo-4-hydroxy)phenylmethyl)-4-N-(3-(hydroxyamino-3-oxo-1-phenylmethyl)propyl)amino-4-oxobutanoic acid
Computed Properties
Molecular Weight:526.3
XLogP3:2
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:526.06008
Monoisotopic Mass:526.06008
Topological Polar Surface Area:136
Heavy Atom Count:30
Complexity:584
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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