2-[[2-[3-[bis(2-hydroxyethylamino)phosphorylamino]phenyl]-1-carboxyethyl]carbamoyl]benzoic acid
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![2-[[2-[3-[bis(2-hydroxyethylamino)phosphorylamino]phenyl]-1-carboxyethyl]carbamoyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/27130d954c9a4dada03367714b062527.png "2-[[2-[3-[bis(2-hydroxyethylamino)phosphorylamino]phenyl]-1-carboxyethyl]carbamoyl]benzoic acid")
2-[[2-[3-[bis(2-hydroxyethylamino)phosphorylamino]phenyl]-1-carboxyethyl]carbamoyl]benzoic acid
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CAS No:
100628-55-5
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Formula:
C21H27N4O8P
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Chemical Name:
2-[[2-[3-[bis(2-hydroxyethylamino)phosphorylamino]phenyl]-1-carboxyethyl]carbamoyl]benzoic acid
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Synonyms:
100628-55-5;NSC70807;DTXSID90905631;2-[[1-[[3-[bis(2-hydroxyethylamino)phosphorylamino]phenyl]methyl]-2-hydroxy-2-oxo-ethyl]carbamoyl]benzoic acid;3-({Bis[(2-hydroxyethyl)amino]phosphoryl}amino)-N-[(2-carboxyphenyl)(hydroxy)methylidene]phenylalanine
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CAS No:
2-[[2-[3-[bis(2-hydroxyethylamino)phosphorylamino]phenyl]-1-carboxyethyl]carbamoyl]benzoic acid Basic Attributes
494.4 g/mol
494.15665083 g/mol
Computed Properties
Molecular Weight:494.4
XLogP3:-0.2
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:14
Exact Mass:494.15665083
Monoisotopic Mass:494.15665083
Topological Polar Surface Area:197
Heavy Atom Count:34
Complexity:728
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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