N-(4-methoxyphenyl)-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-methoxyphenyl)-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/20220811/4155b1dda1ad4a08a9cb8c4cc7a969dc.png "N-(4-methoxyphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide")
N-(4-methoxyphenyl)-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:
540773-41-9
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Formula:
C29H26N4OS
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Chemical Name:
N-(4-methoxyphenyl)-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:
Oprea1_378366;ZINC2246283;STK657158;AKOS005587793;MCULE-4879676124;540773-41-9;N-(4-methoxyphenyl)-1,4-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
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CAS No:
N-(4-methoxyphenyl)-2,6-diphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
478.6 g/mol
478.18273264 g/mol
Computed Properties
Molecular Weight:478.6
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:478.18273264
Monoisotopic Mass:478.18273264
Topological Polar Surface Area:75.6
Heavy Atom Count:35
Complexity:716
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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