4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid
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![4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/975761ee91ed4101a88cf547926578ff.png "4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid")
4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid
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CAS No:
899388-84-2
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Formula:
C21H28N4O4
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Chemical Name:
4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid
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Synonyms:
ZINC2327071;EiM07-17598;STK716975;AKOS005533717;AKOS032395292;ZINC102674199;ZINC238901753;MCULE-7362738124;4-((6-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)hexanamido)methyl)cyclohexanecarboxylic acid;(1r,4r)-4-((6-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)hexanamido)methyl)cyclohexanecarboxylic acid;899388-84-2;trans-4-({[6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanoyl]amino}methyl)cyclohexanecarboxylic acid
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CAS No:
4-[[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid Basic Attributes
400.5 g/mol
400.21105539 g/mol
Computed Properties
Molecular Weight:400.5
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:400.21105539
Monoisotopic Mass:400.21105539
Topological Polar Surface Area:111
Heavy Atom Count:29
Complexity:616
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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