N,2,6-triphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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N,2,6-triphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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CAS No:
540773-40-8
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Formula:
C28H24N4S
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Chemical Name:
N,2,6-triphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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Synonyms:
Oprea1_051242;C28H24N4S;ZINC2255193;STL006577;AKOS005683259;MCULE-7774189232;N,1,4-triphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide;540773-40-8
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CAS No:
N,2,6-triphenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
448.6 g/mol
448.17216796 g/mol
Computed Properties
Molecular Weight:448.6
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:448.17216796
Monoisotopic Mass:448.17216796
Topological Polar Surface Area:66.4
Heavy Atom Count:33
Complexity:667
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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