(1-ethyl-1-methylpiperidin-1-ium-4-yl) 2-(azepan-1-yl)-2-(1,2-benzoxazol-3-yl)acetate;iodide
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(1-ethyl-1-methylpiperidin-1-ium-4-yl) 2-(azepan-1-yl)-2-(1,2-benzoxazol-3-yl)acetate;iodide
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CAS No:
86434-57-3
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Formula:
C23H34IN3O3
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Chemical Name:
(1-ethyl-1-methylpiperidin-1-ium-4-yl) 2-(azepan-1-yl)-2-(1,2-benzoxazol-3-yl)acetate;iodide
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Synonyms:
4-(2-(1,2-benzisoxazole-3-yl)-2-(hexahydro-1H-azepin-1-yl)acetoxy)-1-ethyl-1-methylpiperidinium iodide;SX 810;SX-810;Beperidium Iodide;86434-57-3;SX 810;(1-ethyl-1-methylpiperidin-1-ium-4-yl) 2-(azepan-1-yl)-2-(1,2-benzoxazol-3-yl)acetate;iodide;BeperidiumIodide;SCHEMBL1816490;CHEMBL2104138;DTXSID001006843;HY-100152;CS-0018140;4-{[(Azepan-1-yl)(1,2-benzoxazol-3-yl)acetyl]oxy}-1-ethyl-1-methylpiperidin-1-ium iodide
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CAS No:
(1-ethyl-1-methylpiperidin-1-ium-4-yl) 2-(azepan-1-yl)-2-(1,2-benzoxazol-3-yl)acetate;iodide Basic Attributes
527.4 g/mol
527.16449 g/mol
Drug Information
4-(2-(1,2-benzisoxazole-3-yl)-2-(hexahydro-1H-azepin-1-yl)acetoxy)-1-ethyl-1-methylpiperidinium iodide
Computed Properties
Molecular Weight:527.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:527.16449
Monoisotopic Mass:527.16449
Topological Polar Surface Area:55.6
Heavy Atom Count:30
Complexity:542
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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