 Home > Encyclopedia > 6-(4-fluorophenyl)-N-(2-methylphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

6-(4-fluorophenyl)-N-(2-methylphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

6-(4-fluorophenyl)-N-(2-methylphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide structure

CAS No:
488714-97-2
Formula:
C31H28FN3S
Chemical Name:
6-(4-fluorophenyl)-N-(2-methylphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
Synonyms:
C31H28FN3S;ZINC2336319;STK783840;AKOS005620060;MCULE-9275318731;1-(4-fluorophenyl)-N-(2-methylphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide;488714-97-2

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6-(4-fluorophenyl)-N-(2-methylphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide Basic Attributes

Molecular Weight：

493.6 g/mol

Exact Mass：

493.19879724 g/mol

Characteristics

PSA：

53.5 Å²

Computed Properties

Molecular Weight:493.6
XLogP3:8.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:493.19879724
Monoisotopic Mass:493.19879724
Topological Polar Surface Area:53.5
Heavy Atom Count:36
Complexity:761
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-(4-fluorophenyl)-N-(2-methylphenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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