2-(11-methyl-2-oxo-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-3-yl)acetonitrile
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![2-(11-methyl-2-oxo-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-3-yl)acetonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/99b70341f7254785b2f57bb49603459a.png "2-(11-methyl-2-oxo-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-3-yl)acetonitrile")
2-(11-methyl-2-oxo-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-3-yl)acetonitrile
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CAS No:
136723-05-2
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Formula:
C16H20N4O
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Chemical Name:
2-(11-methyl-2-oxo-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-3-yl)acetonitrile
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Synonyms:
136723-05-2;(+-)-4,5,6,7-Tetrahydro-5-methyl-2-oxo-6-propylimidazo(4,5,1-jk)(1,4)benzodiazepine-1(2H)-acetonitrile;Imidazo(4,5,1-jk)(1,4)benzodiazepine-1(2H)-acetonitrile, 4,5,6,7-tetrahydro-5-methyl-2-oxo-6-propyl-;(+-)-4,5,6,7-Tetrahydro-5-methyl-2-oxo-6-propylimidazo[4,5,1-jk][1,4]benzodiazepine-1(2H)-acetonitrile;Imidazo[4,5,1-jk][1,4]benzodiazepine-1(2H)-acetonitrile, 4,5,6,7-tetrahydro-5-methyl-2-oxo-6-propyl-;CHEMBL111177;DTXSID40929529;2-(methyl-oxo-propyl-[?]yl)acetonitrile;(5-Methyl-2-oxo-6-propyl-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1,4]benzodiazepin-1(2H)-yl)acetonitrile;4,5,6,7-Tetrahydro-1-cyanomethyl-5-methyl-6-propylimidazo[4,5,1-jk][1,4]benzodiazepin-2(1H)-one
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CAS No:
2-(11-methyl-2-oxo-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-3-yl)acetonitrile Basic Attributes
284.36 g/mol
284.16371127 g/mol
Computed Properties
Molecular Weight:284.36
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:284.16371127
Monoisotopic Mass:284.16371127
Topological Polar Surface Area:50.6
Heavy Atom Count:21
Complexity:456
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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