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2-(4-methylphenyl)-N,6-diphenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
2-(4-methylphenyl)-N,6-diphenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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![2-(4-methylphenyl)-N,6-diphenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ccc998f1ea8c425e9a83a7687ca7103d.png "2-(4-methylphenyl)-N,6-diphenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide")
2-(4-methylphenyl)-N,6-diphenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
structure -
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CAS No:
500268-39-3
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Formula:
C30H27N3S
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Chemical Name:
2-(4-methylphenyl)-N,6-diphenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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Synonyms:
ZINC2321914;STK783828;AKOS005615492;MCULE-7563119756;4-(4-methylphenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide;500268-39-3
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CAS No:
2-(4-methylphenyl)-N,6-diphenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
461.6 g/mol
461.19256905 g/mol
Computed Properties
Molecular Weight:461.6
XLogP3:7.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:461.19256905
Monoisotopic Mass:461.19256905
Topological Polar Surface Area:53.5
Heavy Atom Count:34
Complexity:691
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-(4-methylphenyl)-N,6-diphenyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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