4-oxo-4-[2-(phenylcarbamothioylamino)ethylamino]butanoic acid
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![4-oxo-4-[2-(phenylcarbamothioylamino)ethylamino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ac43d68a958b4093ab4b02b5b826302b.png "4-oxo-4-[2-(phenylcarbamothioylamino)ethylamino]butanoic acid")
4-oxo-4-[2-(phenylcarbamothioylamino)ethylamino]butanoic acid
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CAS No:
380207-85-2
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Formula:
C13H17N3O3S
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Chemical Name:
4-oxo-4-[2-(phenylcarbamothioylamino)ethylamino]butanoic acid
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Synonyms:
ZINC2703211;AKOS001020940;MCULE-6387192598;ST50036521;SR-01000237118;SR-01000237118-1;Z56814593;3-({2-[(phenylcarbamothioyl)amino]ethyl}carbamoyl)propanoic acid;4-({2-[(anilinocarbonothioyl)amino]ethyl}amino)-4-oxobutanoic acid;3-[N-(2-{[(phenylamino)thioxomethyl]amino}ethyl)carbamoyl]propanoic acid;380207-85-2
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CAS No:
4-oxo-4-[2-(phenylcarbamothioylamino)ethylamino]butanoic acid Basic Attributes
295.36 g/mol
295.09906259 g/mol
Computed Properties
Molecular Weight:295.36
XLogP3:0.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:295.09906259
Monoisotopic Mass:295.09906259
Topological Polar Surface Area:123
Heavy Atom Count:20
Complexity:344
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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