2-(4-chlorophenyl)-6-(4-methylphenyl)-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-chlorophenyl)-6-(4-methylphenyl)-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:
496771-05-2
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Formula:
C27H26ClN3S
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Chemical Name:
2-(4-chlorophenyl)-6-(4-methylphenyl)-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:
C27H26ClN3S;ZINC1816751;STK541608;AKOS005471499;MCULE-2609301413;4-(4-chlorophenyl)-1-(4-methylphenyl)-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide;496771-05-2
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CAS No:
2-(4-chlorophenyl)-6-(4-methylphenyl)-N-prop-2-enyl-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes
460.0 g/mol
459.1535967 g/mol
Computed Properties
Molecular Weight:460.0
XLogP3:7.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:459.1535967
Monoisotopic Mass:459.1535967
Topological Polar Surface Area:53.5
Heavy Atom Count:32
Complexity:670
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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