2-[2-hydroxy-3-[[1-(5-hydroxy-1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile
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![2-[2-hydroxy-3-[[1-(5-hydroxy-1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/87fbaf07422e4cb791c248d2606360d3.png "2-[2-hydroxy-3-[[1-(5-hydroxy-1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile")
2-[2-hydroxy-3-[[1-(5-hydroxy-1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile
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CAS No:
99541-39-6
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Formula:
C22H25N3O3
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Chemical Name:
2-[2-hydroxy-3-[[1-(5-hydroxy-1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile
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Synonyms:
5-hydroxybucindolol;CHEMBL426596;5-Hydroxybucindolol;2-(2-hydroxy-3-{[1-(5-hydroxy-1h-indol-3-yl)-2-methylpropan-2-yl]amino}propoxy)benzonitrile;2-[2-hydroxy-3-[[1-(5-hydroxy-1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile;99541-39-6;DTXSID80912637;BDBM50169793;2-{2-Hydroxy-3-[2-(5-hydroxy-1H-indol-3-yl)-1,1-dimethyl-ethylamino]-propoxy}-benzonitrile;Benzonitrile, 2-(2-hydroxy-3-((2-(5-hydroxy-1H-indol-3-yl)-1,1-dimethylethyl)amino)propoxy)-
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CAS No:
2-[2-hydroxy-3-[[1-(5-hydroxy-1H-indol-3-yl)-2-methylpropan-2-yl]amino]propoxy]benzonitrile Basic Attributes
379.5 g/mol
379.18959167 g/mol
Computed Properties
Molecular Weight:379.5
XLogP3:2.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:379.18959167
Monoisotopic Mass:379.18959167
Topological Polar Surface Area:101
Heavy Atom Count:28
Complexity:546
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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