11-methyl-10-(3-methylbut-2-enyl)-2-phenylsulfanyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraene
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![11-methyl-10-(3-methylbut-2-enyl)-2-phenylsulfanyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraene structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/fc7932adc62a4122a87df8fce5f38317.png "11-methyl-10-(3-methylbut-2-enyl)-2-phenylsulfanyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraene")
11-methyl-10-(3-methylbut-2-enyl)-2-phenylsulfanyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraene
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CAS No:
136722-82-2
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Formula:
C22H25N3S
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Chemical Name:
11-methyl-10-(3-methylbut-2-enyl)-2-phenylsulfanyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraene
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Synonyms:
136722-82-2;Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-butenyl)-2-(phenylthio)-;Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-butenyl)-2-(phenylthio)-, (1)-;Imidazo[4,5,1-jk][1,4]benzodiazepine, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-butenyl)-2-(phenylthio)-;Imidazo[4,5,1-jk][1,4]benzodiazepine, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-butenyl)-2-(phenylthio)-, (1)-;CHEMBL108092;DTXSID60929521;methyl-(3-methylbut-2-enyl)-phenylsulfanyl-[?];4,5,6,7-Tetrahydro-2-phenylthio-5-methyl-6-(3-methyl-2-butenyl)imidazo[4,5,1-jk][1,4]benzodiazepine;5-Methyl-6-(3-methylbut-2-en-1-yl)-2-(phenylsulfanyl)-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1,4]benzodiazepine
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CAS No:
11-methyl-10-(3-methylbut-2-enyl)-2-phenylsulfanyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraene Basic Attributes
363.5 g/mol
363.17691898 g/mol
Computed Properties
Molecular Weight:363.5
XLogP3:5.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:363.17691898
Monoisotopic Mass:363.17691898
Topological Polar Surface Area:46.4
Heavy Atom Count:26
Complexity:498
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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