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N-(4-methylphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
N-(4-methylphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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![N-(4-methylphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/740eccd18ae64f57a13f610e2c10a034.png "N-(4-methylphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide")
N-(4-methylphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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CAS No:
540773-38-4
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Formula:
C29H26N4S
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Chemical Name:
N-(4-methylphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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Synonyms:
ZINC2245922;STL006528;AKOS016366402;MCULE-9356147174;540773-38-4;N-(4-methylphenyl)-1,4-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
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CAS No:
N-(4-methylphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
462.6 g/mol
462.18781802 g/mol
Computed Properties
Molecular Weight:462.6
XLogP3:6.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:462.18781802
Monoisotopic Mass:462.18781802
Topological Polar Surface Area:66.4
Heavy Atom Count:34
Complexity:694
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of N-(4-methylphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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