6-(4-methylphenyl)-2-phenyl-N-(2-phenylethyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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6-(4-methylphenyl)-2-phenyl-N-(2-phenylethyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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CAS No:
379730-13-9
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Formula:
C31H30N4S
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Chemical Name:
6-(4-methylphenyl)-2-phenyl-N-(2-phenylethyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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Synonyms:
ZINC3227394;AKOS034458594;MCULE-2902773186;Z56827881;379730-13-9;6-(4-methylphenyl)-2-phenyl-N-(2-phenylethyl)-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene-5-carbothioamide
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CAS No:
6-(4-methylphenyl)-2-phenyl-N-(2-phenylethyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
490.7 g/mol
490.21911815 g/mol
Computed Properties
Molecular Weight:490.7
XLogP3:7.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:490.21911815
Monoisotopic Mass:490.21911815
Topological Polar Surface Area:66.4
Heavy Atom Count:36
Complexity:724
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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