2-(3,4-dimethylphenyl)-N,6-bis(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide
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![2-(3,4-dimethylphenyl)-N,6-bis(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/25becf0d62ab4481a7dd9c9317b919ff.png "2-(3,4-dimethylphenyl)-N,6-bis(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide")
2-(3,4-dimethylphenyl)-N,6-bis(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide
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CAS No:
896168-99-3
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Formula:
C33H33N3O
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Chemical Name:
2-(3,4-dimethylphenyl)-N,6-bis(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide
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Synonyms:
ZINC2338846;STL050789;AKOS005703787;MCULE-7484415776;4-(3,4-dimethylphenyl)-N,1-bis(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide;896168-99-3
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CAS No:
2-(3,4-dimethylphenyl)-N,6-bis(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide Basic Attributes
487.6 g/mol
487.262362685 g/mol
Computed Properties
Molecular Weight:487.6
XLogP3:8.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:487.262362685
Monoisotopic Mass:487.262362685
Topological Polar Surface Area:38.4
Heavy Atom Count:37
Complexity:784
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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