10-(2-bromoprop-2-enyl)-11-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one
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![10-(2-bromoprop-2-enyl)-11-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/dd8f1ccd038a4ce48b4e748daaed24bd.png "10-(2-bromoprop-2-enyl)-11-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one")
10-(2-bromoprop-2-enyl)-11-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one
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CAS No:
141114-20-7
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Formula:
C14H16BrN3O
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Chemical Name:
10-(2-bromoprop-2-enyl)-11-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one
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Synonyms:
141114-20-7;2-bromoallyl(methyl)[?]one;CHEMBL351957;SCHEMBL7904426;DTXSID80930992;6-(2-Bromopropen-3-yl)-4,5,6,7-tetrahydro-5-methylimidazo-(4,5,1-jk)(1,4)-benzodiazepin-2(1H)-one;Imidazo(4,5,1-jk)(1,4)benzodiazepin-2(1H)-one, 6-(2-bromo-2-propenyl)-4,5,6,7-tetrahydro-5-methyl-;(+/-)-6-(2-Bromopropen-3-yl)-4,5,6,7-tetrahydro-5-methylimidazo-[4,5,1-jk][1,4]-benzodiazepin-2(1H)-one;4,5,6,7-Tetrahydro-5-methyl-6-(2-bromo-2-propenyl)imidazo[4,5,1-jk][1,4]benzodiazepin-2(1H)-one;6-(2-Bromoprop-2-en-1-yl)-5-methyl-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1,4]benzodiazepin-2-ol
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CAS No:
10-(2-bromoprop-2-enyl)-11-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one Basic Attributes
322.20 g/mol
321.04767 g/mol
Computed Properties
Molecular Weight:322.20
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:321.04767
Monoisotopic Mass:321.04767
Topological Polar Surface Area:35.6
Heavy Atom Count:19
Complexity:400
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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