N-(3-methylphenyl)-2-(4-methylphenyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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![N-(3-methylphenyl)-2-(4-methylphenyl)-6-phenyl-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/bdc27bc918e347f5a4f8717e3d246f53.png "N-(3-methylphenyl)-2-(4-methylphenyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide")
N-(3-methylphenyl)-2-(4-methylphenyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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CAS No:
524036-81-5
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Formula:
C30H28N4S
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Chemical Name:
N-(3-methylphenyl)-2-(4-methylphenyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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Synonyms:
Oprea1_128879;ZINC2192660;STK768985;AKOS001745018;MCULE-5722099463;ST4073880;SR-01000539851;SR-01000539851-1;524036-81-5;N-(3-methylphenyl)-1-(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide;N~3~-(3-methylphenyl)-1-(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
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CAS No:
N-(3-methylphenyl)-2-(4-methylphenyl)-6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
476.6 g/mol
476.20346808 g/mol
Computed Properties
Molecular Weight:476.6
XLogP3:7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:476.20346808
Monoisotopic Mass:476.20346808
Topological Polar Surface Area:66.4
Heavy Atom Count:35
Complexity:730
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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