2-(4-bromophenyl)-6-phenyl-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
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![2-(4-bromophenyl)-6-phenyl-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0f95a76a62824e97aef1e1fa66807fa8.png "2-(4-bromophenyl)-6-phenyl-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide")
2-(4-bromophenyl)-6-phenyl-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:
300568-57-4
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Formula:
C26H24BrN3S
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Chemical Name:
2-(4-bromophenyl)-6-phenyl-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:
300568-57-4;N-allyl-4-(4-bromophenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide;2-(4-bromophenyl)-6-phenyl-N-(prop-2-en-1-yl)-1,4-diazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene-5-carbothioamide;ChemDiv1_028246;MixCom6_000438;Oprea1_005203;HMS667D20;ZINC1833640;STK721902;AKOS001034005;MCULE-7819321319;UPCMLD0ENAT0500-5070:001;ST50113010;F0227-0180;2-(4-bromophenyl)-6-phenyl-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide;4-(4-bromophenyl)-1-phenyl-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
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CAS No:
2-(4-bromophenyl)-6-phenyl-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
490.5 g/mol
489.08743 g/mol
Computed Properties
Molecular Weight:490.5
XLogP3:7.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:489.08743
Monoisotopic Mass:489.08743
Topological Polar Surface Area:53.5
Heavy Atom Count:31
Complexity:643
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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