6-(4-bromophenyl)-2-(4-methoxyphenyl)-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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6-(4-bromophenyl)-2-(4-methoxyphenyl)-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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CAS No:
488823-92-3
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Formula:
C27H26BrN3OS
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Chemical Name:
6-(4-bromophenyl)-2-(4-methoxyphenyl)-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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Synonyms:
Oprea1_231538;ZINC2366350;STK616360;AKOS005550747;MCULE-6887960758;1-(4-bromophenyl)-4-(4-methoxyphenyl)-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide;488823-92-3
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CAS No:
6-(4-bromophenyl)-2-(4-methoxyphenyl)-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
520.5 g/mol
519.09800 g/mol
Computed Properties
Molecular Weight:520.5
XLogP3:7.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:519.09800
Monoisotopic Mass:519.09800
Topological Polar Surface Area:62.7
Heavy Atom Count:33
Complexity:691
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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